N-[(3-benzamidophenyl)carbamothioyl]-4-hexoxy-benzamide

Systemtic Name: N-[(3-benzamidophenyl)carbamothioyl]-4-hexoxy-benzamide Openeye Name: N-[(3-benzamidophenyl)carbamothioyl]-4-hexoxy-benzamide CAS Name: N-[(3-benzamidoanilino)-sulfanylidenemethyl]-4-hexoxybenzamide IUPAC Name: N-[(3-benzamidophenyl)carbamothioyl]-4-hexoxybenzamide Traditional Name: N-[(3-benzamidophenyl)thiocarbamoyl]-4-hexoxy-benzamide Formula: C27H29N3O3S MolecularWeight: 475.60246

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)C3=CC=CC=C3

InChI

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