cyclohexyl 4-[2-(4-chlorophenyl)sulfanylethanoylamino]benzoate

Systemtic Name: cyclohexyl 4-[2-(4-chlorophenyl)sulfanylethanoylamino]benzoate Openeye Name: cyclohexyl 4-[[2-(4-chlorophenyl)sulfanylacetyl]amino]benzoate CAS Name: 4-[[2-[(4-chlorophenyl)thio]-1-oxoethyl]amino]benzoic acid cyclohexyl ester IUPAC Name: cyclohexyl 4-[[2-(4-chlorophenyl)sulfanylacetyl]amino]benzoate Traditional Name: 4-[[2-[(4-chlorophenyl)thio]acetyl]amino]benzoic acid cyclohexyl ester Formula: C21H22ClNO3S MolecularWeight: 403.92228

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC(=O)C2=CC=C(C=C2)NC(=O)CSC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCC(CC1)OC(=O)C2=CC=C(C=C2)NC(=O)CSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H22ClNO3S/c22-16-8-12-19(13-9-16)27-14-20(24)23-17-10-6-15(7-11-17)21(25)26-18-4-2-1-3-5-18/h6-13,18H,1-5,14H2,(H,23,24)