ethyl 4-[(3,4-dimethoxyphenyl)carbamothioylhydrazinylidene]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[(3,4-dimethoxyphenyl)carbamothioylhydrazinylidene]piperidine-1-carboxylate Openeye Name: ethyl 4-[(3,4-dimethoxyphenyl)carbamothioylhydrazono]piperidine-1-carboxylate CAS Name: 4-[[(3,4-dimethoxyanilino)-sulfanylidenemethyl]hydrazinylidene]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(3,4-dimethoxyphenyl)carbamothioylhydrazinylidene]piperidine-1-carboxylate Traditional Name: 4-[(3,4-dimethoxyphenyl)thiocarbamoylhydrazono]piperidine-1-carboxylic acid ethyl ester Formula: C17H24N4O4S MolecularWeight: 380.46186

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(=NNC(=S)NC2=CC(=C(C=C2)OC)OC)CC1

Isomeric SMILES

CCOC(=O)N1CCC(=NNC(=S)NC2=CC(=C(C=C2)OC)OC)CC1

InChI

InChI=1S/C17H24N4O4S/c1-4-25-17(22)21-9-7-12(8-10-21)19-20-16(26)18-13-5-6-14(23-2)15(11-13)24-3/h5-6,11H,4,7-10H2,1-3H3,(H2,18,20,26)