N-[2-cyanoethyl-(phenylmethyl)carbamothioyl]-2-(2-methoxyethoxy)benzamide

Systemtic Name: N-[2-cyanoethyl-(phenylmethyl)carbamothioyl]-2-(2-methoxyethoxy)benzamide Openeye Name: N-[benzyl(2-cyanoethyl)carbamothioyl]-2-(2-methoxyethoxy)benzamide CAS Name: N-[[2-cyanoethyl-(phenylmethyl)amino]-sulfanylidenemethyl]-2-(2-methoxyethoxy)benzamide IUPAC Name: N-[benzyl(2-cyanoethyl)carbamothioyl]-2-(2-methoxyethoxy)benzamide Traditional Name: N-[benzyl(2-cyanoethyl)thiocarbamoyl]-2-(2-methoxyethoxy)benzamide Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=CC=CC=C1C(=O)NC(=S)N(CCC#N)CC2=CC=CC=C2

Isomeric SMILES

COCCOC1=CC=CC=C1C(=O)NC(=S)N(CCC#N)CC2=CC=CC=C2

InChI

InChI=1S/C21H23N3O3S/c1-26-14-15-27-19-11-6-5-10-18(19)20(25)23-21(28)24(13-7-12-22)16-17-8-3-2-4-9-17/h2-6,8-11H,7,13-16H2,1H3,(H,23,25,28)