N-[[4-[methyl(phenyl)carbamoyl]phenyl]carbamothioyl]-2-(2-methylpropoxy)benzamide

Systemtic Name: N-[[4-[methyl(phenyl)carbamoyl]phenyl]carbamothioyl]-2-(2-methylpropoxy)benzamide Openeye Name: 2-isobutoxy-N-[[4-[methyl(phenyl)carbamoyl]phenyl]carbamothioyl]benzamide CAS Name: N-[[4-[(N-methylanilino)-oxomethyl]anilino]-sulfanylidenemethyl]-2-(2-methylpropoxy)benzamide IUPAC Name: N-[[4-[methyl(phenyl)carbamoyl]phenyl]carbamothioyl]-2-(2-methylpropoxy)benzamide Traditional Name: 2-isobutoxy-N-[[4-[methyl(phenyl)carbamoyl]phenyl]thiocarbamoyl]benzamide Formula: C26H27N3O3S MolecularWeight: 461.57588

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=CC=C1C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)N(C)C3=CC=CC=C3

Isomeric SMILES

CC(C)COC1=CC=CC=C1C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)N(C)C3=CC=CC=C3

InChI

InChI=1S/C26H27N3O3S/c1-18(2)17-32-23-12-8-7-11-22(23)24(30)28-26(33)27-20-15-13-19(14-16-20)25(31)29(3)21-9-5-4-6-10-21/h4-16,18H,17H2,1-3H3,(H2,27,28,30,33)