N-(5-chloranyl-2-methoxy-phenyl)-3-[1-(2-methylsulfanylethanoyl)piperidin-3-yl]propanamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-3-[1-(2-methylsulfanylethanoyl)piperidin-3-yl]propanamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-3-[1-(2-methylsulfanylacetyl)-3-piperidyl]propanamide CAS Name: N-(5-chloro-2-methoxyphenyl)-3-[1-[2-(methylthio)-1-oxoethyl]-3-piperidinyl]propanamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-3-[1-(2-methylsulfanylacetyl)piperidin-3-yl]propanamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-3-[1-[2-(methylthio)acetyl]-3-piperidyl]propionamide Formula: C18H25ClN2O3S MolecularWeight: 384.9207

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=O)CCC2CCCN(C2)C(=O)CSC

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=O)CCC2CCCN(C2)C(=O)CSC

InChI

InChI=1S/C18H25ClN2O3S/c1-24-16-7-6-14(19)10-15(16)20-17(22)8-5-13-4-3-9-21(11-13)18(23)12-25-2/h6-7,10,13H,3-5,8-9,11-12H2,1-2H3,(H,20,22)