3-butoxy-N-[[4-[(phenylmethyl)carbamoyl]phenyl]carbamothioyl]benzamide

Systemtic Name: 3-butoxy-N-[[4-[(phenylmethyl)carbamoyl]phenyl]carbamothioyl]benzamide Openeye Name: N-[[4-(benzylcarbamoyl)phenyl]carbamothioyl]-3-butoxy-benzamide CAS Name: 3-butoxy-N-[[4-[oxo-[(phenylmethyl)amino]methyl]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[[4-(benzylcarbamoyl)phenyl]carbamothioyl]-3-butoxybenzamide Traditional Name: N-[[4-(benzylcarbamoyl)phenyl]thiocarbamoyl]-3-butoxy-benzamide Formula: C26H27N3O3S MolecularWeight: 461.57588

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C26H27N3O3S/c1-2-3-16-32-23-11-7-10-21(17-23)25(31)29-26(33)28-22-14-12-20(13-15-22)24(30)27-18-19-8-5-4-6-9-19/h4-15,17H,2-3,16,18H2,1H3,(H,27,30)(H2,28,29,31,33)