[1-[1-[(4-methylsulfanylphenyl)methyl]piperidin-4-yl]piperidin-4-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [1-[1-[(4-methylsulfanylphenyl)methyl]piperidin-4-yl]piperidin-4-yl]-pyrrolidin-1-yl-methanone Openeye Name: [1-[1-[(4-methylsulfanylphenyl)methyl]-4-piperidyl]-4-piperidyl]-pyrrolidin-1-yl-methanone CAS Name: [1-[1-[[4-(methylthio)phenyl]methyl]-4-piperidinyl]-4-piperidinyl]-(1-pyrrolidinyl)methanone IUPAC Name: [1-[1-[(4-methylsulfanylphenyl)methyl]piperidin-4-yl]piperidin-4-yl]-pyrrolidin-1-ylmethanone Traditional Name: [1-[1-[4-(methylthio)benzyl]-4-piperidyl]-4-piperidyl]-pyrrolidino-methanone Formula: C23H35N3OS MolecularWeight: 401.6085

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CN2CCC(CC2)N3CCC(CC3)C(=O)N4CCCC4

Isomeric SMILES

CSC1=CC=C(C=C1)CN2CCC(CC2)N3CCC(CC3)C(=O)N4CCCC4

InChI

InChI=1S/C23H35N3OS/c1-28-22-6-4-19(5-7-22)18-24-14-10-21(11-15-24)25-16-8-20(9-17-25)23(27)26-12-2-3-13-26/h4-7,20-21H,2-3,8-18H2,1H3