2-pentoxy-N-[[4-[(phenylmethyl)carbamoyl]phenyl]carbamothioyl]benzamide

Systemtic Name: 2-pentoxy-N-[[4-[(phenylmethyl)carbamoyl]phenyl]carbamothioyl]benzamide Openeye Name: N-[[4-(benzylcarbamoyl)phenyl]carbamothioyl]-2-pentoxy-benzamide CAS Name: N-[[4-[oxo-[(phenylmethyl)amino]methyl]anilino]-sulfanylidenemethyl]-2-pentoxybenzamide IUPAC Name: N-[[4-(benzylcarbamoyl)phenyl]carbamothioyl]-2-pentoxybenzamide Traditional Name: 2-amoxy-N-[[4-(benzylcarbamoyl)phenyl]thiocarbamoyl]benzamide Formula: C27H29N3O3S MolecularWeight: 475.60246

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C27H29N3O3S/c1-2-3-9-18-33-24-13-8-7-12-23(24)26(32)30-27(34)29-22-16-14-21(15-17-22)25(31)28-19-20-10-5-4-6-11-20/h4-8,10-17H,2-3,9,18-19H2,1H3,(H,28,31)(H2,29,30,32,34)