3,4-diethoxy-N-[2-oxidanylidene-2-[2-[(phenylmethyl)carbamothioyl]hydrazinyl]ethyl]benzamide

Systemtic Name: 3,4-diethoxy-N-[2-oxidanylidene-2-[2-[(phenylmethyl)carbamothioyl]hydrazinyl]ethyl]benzamide Openeye Name: N-[2-[2-(benzylcarbamothioyl)hydrazino]-2-oxo-ethyl]-3,4-diethoxy-benzamide CAS Name: 3,4-diethoxy-N-[2-oxo-2-[[[(phenylmethyl)amino]-sulfanylidenemethyl]hydrazo]ethyl]benzamide IUPAC Name: N-[2-[2-(benzylcarbamothioyl)hydrazinyl]-2-oxoethyl]-3,4-diethoxybenzamide Traditional Name: N-[2-[N'-(benzylthiocarbamoyl)hydrazino]-2-keto-ethyl]-3,4-diethoxy-benzamide Formula: C21H26N4O4S MolecularWeight: 430.52054

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NCC(=O)NNC(=S)NCC2=CC=CC=C2)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NCC(=O)NNC(=S)NCC2=CC=CC=C2)OCC

InChI

InChI=1S/C21H26N4O4S/c1-3-28-17-11-10-16(12-18(17)29-4-2)20(27)22-14-19(26)24-25-21(30)23-13-15-8-6-5-7-9-15/h5-12H,3-4,13-14H2,1-2H3,(H,22,27)(H,24,26)(H2,23,25,30)