N-[2,5-diethoxy-4-[(phenylmethyl)carbamothioylamino]phenyl]benzamide

Systemtic Name: N-[2,5-diethoxy-4-[(phenylmethyl)carbamothioylamino]phenyl]benzamide Openeye Name: N-[4-(benzylcarbamothioylamino)-2,5-diethoxy-phenyl]benzamide CAS Name: N-[2,5-diethoxy-4-[[[(phenylmethyl)amino]-sulfanylidenemethyl]amino]phenyl]benzamide IUPAC Name: N-[4-(benzylcarbamothioylamino)-2,5-diethoxyphenyl]benzamide Traditional Name: N-[4-(benzylthiocarbamoylamino)-2,5-diethoxy-phenyl]benzamide Formula: C25H27N3O3S MolecularWeight: 449.56518

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)OCC)NC(=S)NCC3=CC=CC=C3

Isomeric SMILES

CCOC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)OCC)NC(=S)NCC3=CC=CC=C3

InChI

InChI=1S/C25H27N3O3S/c1-3-30-22-16-21(28-25(32)26-17-18-11-7-5-8-12-18)23(31-4-2)15-20(22)27-24(29)19-13-9-6-10-14-19/h5-16H,3-4,17H2,1-2H3,(H,27,29)(H2,26,28,32)