N-[4-(methoxymethyl)-1-[2-(1-methylimidazol-2-yl)ethylsulfanyl]piperidin-4-yl]-N-phenyl-propanamide

Systemtic Name: N-[4-(methoxymethyl)-1-[2-(1-methylimidazol-2-yl)ethylsulfanyl]piperidin-4-yl]-N-phenyl-propanamide Openeye Name: N-[4-(methoxymethyl)-1-[2-(1-methylimidazol-2-yl)ethylsulfanyl]-4-piperidyl]-N-phenyl-propanamide CAS Name: N-[4-(methoxymethyl)-1-[2-(1-methyl-2-imidazolyl)ethylthio]-4-piperidinyl]-N-phenylpropanamide IUPAC Name: N-[4-(methoxymethyl)-1-[2-(1-methylimidazol-2-yl)ethylsulfanyl]piperidin-4-yl]-N-phenylpropanamide Traditional Name: N-[4-(methoxymethyl)-1-[2-(1-methylimidazol-2-yl)ethylthio]-4-piperidyl]-N-phenyl-propionamide Formula: C22H32N4O2S MolecularWeight: 416.58008

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(C1=CC=CC=C1)C2(CCN(CC2)SCCC3=NC=CN3C)COC

Isomeric SMILES

CCC(=O)N(C1=CC=CC=C1)C2(CCN(CC2)SCCC3=NC=CN3C)COC

InChI

InChI=1S/C22H32N4O2S/c1-4-21(27)26(19-8-6-5-7-9-19)22(18-28-3)11-14-25(15-12-22)29-17-10-20-23-13-16-24(20)2/h5-9,13,16H,4,10-12,14-15,17-18H2,1-3H3