N-[[4-[(3-methylphenyl)carbonylamino]phenyl]carbamothioyl]-2-(2-methylpropoxy)benzamide

Systemtic Name: N-[[4-[(3-methylphenyl)carbonylamino]phenyl]carbamothioyl]-2-(2-methylpropoxy)benzamide Openeye Name: 2-isobutoxy-N-[[4-[(3-methylbenzoyl)amino]phenyl]carbamothioyl]benzamide CAS Name: N-[[4-[[(3-methylphenyl)-oxomethyl]amino]anilino]-sulfanylidenemethyl]-2-(2-methylpropoxy)benzamide IUPAC Name: N-[[4-[(3-methylbenzoyl)amino]phenyl]carbamothioyl]-2-(2-methylpropoxy)benzamide Traditional Name: 2-isobutoxy-N-[[4-(m-toluoylamino)phenyl]thiocarbamoyl]benzamide Formula: C26H27N3O3S MolecularWeight: 461.57588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=CC=C3OCC(C)C

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=CC=C3OCC(C)C

InChI

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