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

Systemtic Name: N-[(3-acetamidophenyl)carbamothioyl]-4-hexoxy-benzamide Openeye Name: N-[(3-acetamidophenyl)carbamothioyl]-4-hexoxy-benzamide CAS Name: N-[(3-acetamidoanilino)-sulfanylidenemethyl]-4-hexoxybenzamide IUPAC Name: N-[(3-acetamidophenyl)carbamothioyl]-4-hexoxybenzamide Traditional Name: N-[(3-acetamidophenyl)thiocarbamoyl]-4-hexoxy-benzamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O3S/c1-3-4-5-6-14-28-20-12-10-17(11-13-20)21(27)25-22(29)24-19-9-7-8-18(15-19)23-16(2)26/h7-13,15H,3-6,14H2,1-2H3,(H,23,26)(H2,24,25,27,29)