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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NNC(=S)NC(=O)C2=CC(=CC=C2)OCC(C)C

Isomeric SMILES

CC1=CC=CC=C1C(=O)NNC(=S)NC(=O)C2=CC(=CC=C2)OCC(C)C

InChI

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