propyl 4-[3-(2-chlorophenyl)propanoylcarbamothioylamino]benzoate

Systemtic Name: propyl 4-[3-(2-chlorophenyl)propanoylcarbamothioylamino]benzoate Openeye Name: propyl 4-[3-(2-chlorophenyl)propanoylcarbamothioylamino]benzoate CAS Name: 4-[[[[3-(2-chlorophenyl)-1-oxopropyl]amino]-sulfanylidenemethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[3-(2-chlorophenyl)propanoylcarbamothioylamino]benzoate Traditional Name: 4-[3-(2-chlorophenyl)propanoylthiocarbamoylamino]benzoic acid propyl ester Formula: C20H21ClN2O3S MolecularWeight: 404.91034

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)CCC2=CC=CC=C2Cl

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)CCC2=CC=CC=C2Cl

InChI

InChI=1S/C20H21ClN2O3S/c1-2-13-26-19(25)15-7-10-16(11-8-15)22-20(27)23-18(24)12-9-14-5-3-4-6-17(14)21/h3-8,10-11H,2,9,12-13H2,1H3,(H2,22,23,24,27)