N'-(2-azanyl-2-sulfanylidene-ethyl)-N-[(3,4-dimethoxyphenyl)methyl]ethanediamide

Systemtic Name: N'-(2-azanyl-2-sulfanylidene-ethyl)-N-[(3,4-dimethoxyphenyl)methyl]ethanediamide Openeye Name: N'-(2-amino-2-thioxo-ethyl)-N-[(3,4-dimethoxyphenyl)methyl]oxamide CAS Name: N'-(2-amino-2-sulfanylideneethyl)-N-[(3,4-dimethoxyphenyl)methyl]oxamide IUPAC Name: N'-(2-amino-2-sulfanylideneethyl)-N-[(3,4-dimethoxyphenyl)methyl]oxamide Traditional Name: N'-(2-amino-2-thioxo-ethyl)-N-veratryl-oxamide Formula: C13H17N3O4S MolecularWeight: 311.35678

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C(=O)NCC(=S)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)C(=O)NCC(=S)N)OC

InChI

InChI=1S/C13H17N3O4S/c1-19-9-4-3-8(5-10(9)20-2)6-15-12(17)13(18)16-7-11(14)21/h3-5H,6-7H2,1-2H3,(H2,14,21)(H,15,17)(H,16,18)