[2-(cyclohexylcarbonylamino)-2-oxidanylidene-ethyl] 3-(4-chlorophenyl)sulfanylpropanoate

Systemtic Name: [2-(cyclohexylcarbonylamino)-2-oxidanylidene-ethyl] 3-(4-chlorophenyl)sulfanylpropanoate Openeye Name: [2-(cyclohexanecarbonylamino)-2-oxo-ethyl] 3-(4-chlorophenyl)sulfanylpropanoate CAS Name: 3-[(4-chlorophenyl)thio]propanoic acid [2-[[cyclohexyl(oxo)methyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(cyclohexanecarbonylamino)-2-oxoethyl] 3-(4-chlorophenyl)sulfanylpropanoate Traditional Name: 3-[(4-chlorophenyl)thio]propionic acid [2-(cyclohexanecarbonylamino)-2-keto-ethyl] ester Formula: C18H22ClNO4S MolecularWeight: 383.88958

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC(=O)COC(=O)CCSC2=CC=C(C=C2)Cl

Isomeric SMILES

C1CCC(CC1)C(=O)NC(=O)COC(=O)CCSC2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H22ClNO4S/c19-14-6-8-15(9-7-14)25-11-10-17(22)24-12-16(21)20-18(23)13-4-2-1-3-5-13/h6-9,13H,1-5,10-12H2,(H,20,21,23)