propyl 4-[(2-methylphenyl)carbamothioylamino]benzoate

Systemtic Name: propyl 4-[(2-methylphenyl)carbamothioylamino]benzoate Openeye Name: propyl 4-(o-tolylcarbamothioylamino)benzoate CAS Name: 4-[[(2-methylanilino)-sulfanylidenemethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[(2-methylphenyl)carbamothioylamino]benzoate Traditional Name: 4-(o-tolylthiocarbamoylamino)benzoic acid propyl ester Formula: C18H20N2O2S MolecularWeight: 328.4286

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC=CC=C2C

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC=CC=C2C

InChI

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