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

Systemtic Name: 2-hexoxy-N-[[3-[(3-methylphenyl)carbamoyl]phenyl]carbamothioyl]benzamide Openeye Name: 2-hexoxy-N-[[3-(m-tolylcarbamoyl)phenyl]carbamothioyl]benzamide CAS Name: 2-hexoxy-N-[[3-[(3-methylanilino)-oxomethyl]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 2-hexoxy-N-[[3-[(3-methylphenyl)carbamoyl]phenyl]carbamothioyl]benzamide Traditional Name: 2-hexoxy-N-[[3-(m-tolylcarbamoyl)phenyl]thiocarbamoyl]benzamide Formula: C28H31N3O3S MolecularWeight: 489.62904

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC3=CC=CC(=C3)C

Isomeric SMILES

CCCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC3=CC=CC(=C3)C

InChI

InChI=1S/C28H31N3O3S/c1-3-4-5-8-17-34-25-16-7-6-15-24(25)27(33)31-28(35)30-23-14-10-12-21(19-23)26(32)29-22-13-9-11-20(2)18-22/h6-7,9-16,18-19H,3-5,8,17H2,1-2H3,(H,29,32)(H2,30,31,33,35)