N-(5-chloranyl-2-methoxy-phenyl)-3-[1-(2-methylsulfanylphenyl)carbonylpiperidin-3-yl]propanamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-3-[1-(2-methylsulfanylphenyl)carbonylpiperidin-3-yl]propanamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-3-[1-(2-methylsulfanylbenzoyl)-3-piperidyl]propanamide CAS Name: N-(5-chloro-2-methoxyphenyl)-3-[1-[[2-(methylthio)phenyl]-oxomethyl]-3-piperidinyl]propanamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-3-[1-(2-methylsulfanylbenzoyl)piperidin-3-yl]propanamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-3-[1-[2-(methylthio)benzoyl]-3-piperidyl]propionamide Formula: C23H27ClN2O3S MolecularWeight: 446.99008

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=O)CCC2CCCN(C2)C(=O)C3=CC=CC=C3SC

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=O)CCC2CCCN(C2)C(=O)C3=CC=CC=C3SC

InChI

InChI=1S/C23H27ClN2O3S/c1-29-20-11-10-17(24)14-19(20)25-22(27)12-9-16-6-5-13-26(15-16)23(28)18-7-3-4-8-21(18)30-2/h3-4,7-8,10-11,14,16H,5-6,9,12-13,15H2,1-2H3,(H,25,27)