1-[1-(1-methylpiperidin-4-yl)piperidin-4-yl]-N-[(3-methylsulfanylphenyl)methyl]-N-(pyridin-4-ylmethyl)methanamine

Systemtic Name: 1-[1-(1-methylpiperidin-4-yl)piperidin-4-yl]-N-[(3-methylsulfanylphenyl)methyl]-N-(pyridin-4-ylmethyl)methanamine Openeye Name: 1-[1-(1-methyl-4-piperidyl)-4-piperidyl]-N-[(3-methylsulfanylphenyl)methyl]-N-(4-pyridylmethyl)methanamine CAS Name: 1-[1-(1-methyl-4-piperidinyl)-4-piperidinyl]-N-[[3-(methylthio)phenyl]methyl]-N-(pyridin-4-ylmethyl)methanamine IUPAC Name: 1-[1-(1-methylpiperidin-4-yl)piperidin-4-yl]-N-[(3-methylsulfanylphenyl)methyl]-N-(pyridin-4-ylmethyl)methanamine Traditional Name: [1-(1-methyl-4-piperidyl)-4-piperidyl]methyl-[3-(methylthio)benzyl]-(4-pyridylmethyl)amine Formula: C26H38N4S MolecularWeight: 438.67172

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)N2CCC(CC2)CN(CC3=CC=NC=C3)CC4=CC(=CC=C4)SC

Isomeric SMILES

CN1CCC(CC1)N2CCC(CC2)CN(CC3=CC=NC=C3)CC4=CC(=CC=C4)SC

InChI

InChI=1S/C26H38N4S/c1-28-14-10-25(11-15-28)30-16-8-23(9-17-30)20-29(19-22-6-12-27-13-7-22)21-24-4-3-5-26(18-24)31-2/h3-7,12-13,18,23,25H,8-11,14-17,19-21H2,1-2H3