methyl 4-methyl-3-[(4-propan-2-ylphenyl)carbamothioylamino]benzoate

Systemtic Name: methyl 4-methyl-3-[(4-propan-2-ylphenyl)carbamothioylamino]benzoate Openeye Name: methyl 3-[(4-isopropylphenyl)carbamothioylamino]-4-methyl-benzoate CAS Name: 4-methyl-3-[[(4-propan-2-ylanilino)-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[(4-propan-2-ylphenyl)carbamothioylamino]benzoate Traditional Name: 4-methyl-3-(p-cumenylthiocarbamoylamino)benzoic acid methyl ester Formula: C19H22N2O2S MolecularWeight: 342.45518

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N2O2S/c1-12(2)14-7-9-16(10-8-14)20-19(24)21-17-11-15(18(22)23-4)6-5-13(17)3/h5-12H,1-4H3,(H2,20,21,24)