propyl 4-[(3-chloranyl-4-methyl-phenyl)carbamothioylamino]benzoate

Systemtic Name: propyl 4-[(3-chloranyl-4-methyl-phenyl)carbamothioylamino]benzoate Openeye Name: propyl 4-[(3-chloro-4-methyl-phenyl)carbamothioylamino]benzoate CAS Name: 4-[[(3-chloro-4-methylanilino)-sulfanylidenemethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[(3-chloro-4-methylphenyl)carbamothioylamino]benzoate Traditional Name: 4-[(3-chloro-4-methyl-phenyl)thiocarbamoylamino]benzoic acid propyl ester Formula: C18H19ClN2O2S MolecularWeight: 362.87366

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC(=C(C=C2)C)Cl

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC(=C(C=C2)C)Cl

InChI

InChI=1S/C18H19ClN2O2S/c1-3-10-23-17(22)13-5-8-14(9-6-13)20-18(24)21-15-7-4-12(2)16(19)11-15/h4-9,11H,3,10H2,1-2H3,(H2,20,21,24)