[2-(cycloheptylamino)-2-oxidanylidene-ethyl] 3-(2-chlorophenyl)sulfanylpropanoate

Systemtic Name: [2-(cycloheptylamino)-2-oxidanylidene-ethyl] 3-(2-chlorophenyl)sulfanylpropanoate Openeye Name: [2-(cycloheptylamino)-2-oxo-ethyl] 3-(2-chlorophenyl)sulfanylpropanoate CAS Name: 3-[(2-chlorophenyl)thio]propanoic acid [2-(cycloheptylamino)-2-oxoethyl] ester IUPAC Name: [2-(cycloheptylamino)-2-oxoethyl] 3-(2-chlorophenyl)sulfanylpropanoate Traditional Name: 3-[(2-chlorophenyl)thio]propionic acid [2-(cycloheptylamino)-2-keto-ethyl] ester Formula: C18H24ClNO3S MolecularWeight: 369.90606

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)COC(=O)CCSC2=CC=CC=C2Cl

Isomeric SMILES

C1CCCC(CC1)NC(=O)COC(=O)CCSC2=CC=CC=C2Cl

InChI

InChI=1S/C18H24ClNO3S/c19-15-9-5-6-10-16(15)24-12-11-18(22)23-13-17(21)20-14-7-3-1-2-4-8-14/h5-6,9-10,14H,1-4,7-8,11-13H2,(H,20,21)