Molecular properties
- Formula
- C13H22N4O3S
- Molar mass
- 314.41 g·mol−1
- Exact mass
- 314.1413 Da
- 5
- PubChem CID
- 3001055
Molecule record
(E)-1-N'-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-1-N-methyl-2-nitroethene-1,1-diamine
C13H22N4O3S
314.41 g/mol
Loading structure
Functional groups
Alkane / alkyl carbon
Alkene
Nitro compound
Secondary amine
Sulfide
Tertiary amine
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- 1,1-Ethenediamine, N-(2-(((5-((dimethylamino)methyl)-2-furanyl)methyl)thio)ethyl)-N'-methyl-2-nitro-
- 266-332-5
- 66357-35-5
- 884KT10YB7
- A02BA02
- AH19065
- CHEBI:8776
- DTXCID00820068
Show all 24 synonyms
- DTXSID8045191
- Gavilast
- Hydrochloride, Ranitidine
- N-(2-((5-(dimethylaminomethyl)furan-2-yl)methylsulfanyl)ethyl)-N'-methyl-2-nitroethene-1,1-diamine
- NSC-757851
- Ranitidin
- Ranitidina
- Ranitidine Base
- Ranitidine bismutrex
- Ranitidinum
- Ratic
- Raticina
- RefChem:6195
- dimethyl[(5-{[(2-{[(E)-1-(methylamino)-2-nitroethenyl]amino}ethyl)sulfanyl]methyl}furan-2-yl)methyl]amine
- n-[2-[[[5-[(dimethylamino)methyl]-2-furanyl]methyl]thio]ethyl]-n'-methyl-2-nitro-1,1-ethenediamine
- ranitidine
Structure identifiers
- Canonical SMILES
- CN/C(=C\[N+](=O)[O-])NCCSCc1ccc(CN(C)C)o1
- Isomeric SMILES
- CN/C(=C\[N+](=O)[O-])/NCCSCC1=CC=C(O1)CN(C)C
- InChI
- InChI=1S/C13H22N4O3S/c1-14-13(9-17(18)19)15-6-7-21-10-12-5-4-11(20-12)8-16(2)3/h4-5,9,14-15H,6-8,10H2,1-3H3/b13-9+
- InChIKey
- VMXUWOKSQNHOCA-UKTHLTGXSA-N
- PubChem CID
- 3001055
Spectroscopy
Tabs appear only for spectra stored with clear provenance.
No redistributable or simulated spectroscopy record is attached yet.
Simulated NMR
On-demand educational prediction for (E)-1-N'-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-1-N-methyl-2-nitroethene-1,1-diamine; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for (E)-1-N'-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-1-N-methyl-2-nitroethene-1,1-diamine; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.