methyl 2-[(2-propan-2-ylphenyl)carbamothioylamino]benzoate

Systemtic Name: methyl 2-[(2-propan-2-ylphenyl)carbamothioylamino]benzoate Openeye Name: methyl 2-[(2-isopropylphenyl)carbamothioylamino]benzoate CAS Name: 2-[[(2-propan-2-ylanilino)-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[(2-propan-2-ylphenyl)carbamothioylamino]benzoate Traditional Name: 2-(o-cumenylthiocarbamoylamino)benzoic acid methyl ester Formula: C18H20N2O2S MolecularWeight: 328.4286

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1NC(=S)NC2=CC=CC=C2C(=O)OC

Isomeric SMILES

CC(C)C1=CC=CC=C1NC(=S)NC2=CC=CC=C2C(=O)OC

InChI

InChI=1S/C18H20N2O2S/c1-12(2)13-8-4-6-10-15(13)19-18(23)20-16-11-7-5-9-14(16)17(21)22-3/h4-12H,1-3H3,(H2,19,20,23)