N-[[3-[(3-methylphenyl)carbamoyl]phenyl]carbamothioyl]-2-pentoxy-benzamide

Systemtic Name: N-[[3-[(3-methylphenyl)carbamoyl]phenyl]carbamothioyl]-2-pentoxy-benzamide Openeye Name: N-[[3-(m-tolylcarbamoyl)phenyl]carbamothioyl]-2-pentoxy-benzamide CAS Name: N-[[3-[(3-methylanilino)-oxomethyl]anilino]-sulfanylidenemethyl]-2-pentoxybenzamide IUPAC Name: N-[[3-[(3-methylphenyl)carbamoyl]phenyl]carbamothioyl]-2-pentoxybenzamide Traditional Name: 2-amoxy-N-[[3-(m-tolylcarbamoyl)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=CC(=C2)C(=O)NC3=CC=CC(=C3)C

Isomeric SMILES

CCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC3=CC=CC(=C3)C

InChI

InChI=1S/C27H29N3O3S/c1-3-4-7-16-33-24-15-6-5-14-23(24)26(32)30-27(34)29-22-13-9-11-20(18-22)25(31)28-21-12-8-10-19(2)17-21/h5-6,8-15,17-18H,3-4,7,16H2,1-2H3,(H,28,31)(H2,29,30,32,34)