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

Systemtic Name: N-[[(4-methylphenyl)carbonylamino]carbamothioyl]-3-(2-methylpropoxy)benzamide Openeye Name: 3-isobutoxy-N-[[(4-methylbenzoyl)amino]carbamothioyl]benzamide CAS Name: N-[[[(4-methylphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-3-(2-methylpropoxy)benzamide IUPAC Name: N-[[(4-methylbenzoyl)amino]carbamothioyl]-3-(2-methylpropoxy)benzamide Traditional Name: 3-isobutoxy-N-[(p-toluoylamino)thiocarbamoyl]benzamide Formula: C20H23N3O3S MolecularWeight: 385.47992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CC(=CC=C2)OCC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CC(=CC=C2)OCC(C)C

InChI

InChI=1S/C20H23N3O3S/c1-13(2)12-26-17-6-4-5-16(11-17)18(24)21-20(27)23-22-19(25)15-9-7-14(3)8-10-15/h4-11,13H,12H2,1-3H3,(H,22,25)(H2,21,23,24,27)