N-[(3-chlorophenyl)methyl]-3-[1-(2-methylsulfanylpyridin-3-yl)carbonylpiperidin-4-yl]propanamide

Systemtic Name: N-[(3-chlorophenyl)methyl]-3-[1-(2-methylsulfanylpyridin-3-yl)carbonylpiperidin-4-yl]propanamide Openeye Name: N-[(3-chlorophenyl)methyl]-3-[1-(2-methylsulfanylpyridine-3-carbonyl)-4-piperidyl]propanamide CAS Name: N-[(3-chlorophenyl)methyl]-3-[1-[[2-(methylthio)-3-pyridinyl]-oxomethyl]-4-piperidinyl]propanamide IUPAC Name: N-[(3-chlorophenyl)methyl]-3-[1-(2-methylsulfanylpyridine-3-carbonyl)piperidin-4-yl]propanamide Traditional Name: N-(3-chlorobenzyl)-3-[1-[2-(methylthio)nicotinoyl]-4-piperidyl]propionamide Formula: C22H26ClN3O2S MolecularWeight: 431.97874

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC=N1)C(=O)N2CCC(CC2)CCC(=O)NCC3=CC(=CC=C3)Cl

Isomeric SMILES

CSC1=C(C=CC=N1)C(=O)N2CCC(CC2)CCC(=O)NCC3=CC(=CC=C3)Cl

InChI

InChI=1S/C22H26ClN3O2S/c1-29-21-19(6-3-11-24-21)22(28)26-12-9-16(10-13-26)7-8-20(27)25-15-17-4-2-5-18(23)14-17/h2-6,11,14,16H,7-10,12-13,15H2,1H3,(H,25,27)