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

Systemtic Name: methyl 4-[[(4-propan-2-ylphenyl)carbamothioylamino]carbamoyl]benzoate Openeye Name: methyl 4-[[(4-isopropylphenyl)carbamothioylamino]carbamoyl]benzoate CAS Name: 4-[oxo-[[(4-propan-2-ylanilino)-sulfanylidenemethyl]hydrazo]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(4-propan-2-ylphenyl)carbamothioylamino]carbamoyl]benzoate Traditional Name: 4-[(p-cumenylthiocarbamoylamino)carbamoyl]benzoic acid methyl ester Formula: C19H21N3O3S MolecularWeight: 371.45334

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=S)NNC(=O)C2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=S)NNC(=O)C2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C19H21N3O3S/c1-12(2)13-8-10-16(11-9-13)20-19(26)22-21-17(23)14-4-6-15(7-5-14)18(24)25-3/h4-12H,1-3H3,(H,21,23)(H2,20,22,26)