methyl 4-[(3-methylphenyl)carbonylcarbamothioylamino]benzoate

Systemtic Name: methyl 4-[(3-methylphenyl)carbonylcarbamothioylamino]benzoate Openeye Name: methyl 4-[(3-methylbenzoyl)carbamothioylamino]benzoate CAS Name: 4-[[[[(3-methylphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(3-methylbenzoyl)carbamothioylamino]benzoate Traditional Name: 4-(m-toluoylthiocarbamoylamino)benzoic acid methyl ester Formula: C17H16N2O3S MolecularWeight: 328.38554

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16N2O3S/c1-11-4-3-5-13(10-11)15(20)19-17(23)18-14-8-6-12(7-9-14)16(21)22-2/h3-10H,1-2H3,(H2,18,19,20,23)