4-[4-(4-butoxyphenyl)piperazin-1-yl]sulfonyl-N-methyl-1-(5-methylpyridin-2-yl)piperidine-4-carboxamide

Systemtic Name: 4-[4-(4-butoxyphenyl)piperazin-1-yl]sulfonyl-N-methyl-1-(5-methylpyridin-2-yl)piperidine-4-carboxamide Openeye Name: 4-[4-(4-butoxyphenyl)piperazin-1-yl]sulfonyl-N-methyl-1-(5-methyl-2-pyridyl)piperidine-4-carboxamide CAS Name: 4-[[4-(4-butoxyphenyl)-1-piperazinyl]sulfonyl]-N-methyl-1-(5-methyl-2-pyridinyl)-4-piperidinecarboxamide IUPAC Name: 4-[4-(4-butoxyphenyl)piperazin-1-yl]sulfonyl-N-methyl-1-(5-methylpyridin-2-yl)piperidine-4-carboxamide Traditional Name: 4-[4-(4-butoxyphenyl)piperazino]sulfonyl-N-methyl-1-(5-methyl-2-pyridyl)isonipecotamide Formula: C27H39N5O4S MolecularWeight: 529.69466

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)N2CCN(CC2)S(=O)(=O)C3(CCN(CC3)C4=NC=C(C=C4)C)C(=O)NC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)N2CCN(CC2)S(=O)(=O)C3(CCN(CC3)C4=NC=C(C=C4)C)C(=O)NC

InChI

InChI=1S/C27H39N5O4S/c1-4-5-20-36-24-9-7-23(8-10-24)30-16-18-32(19-17-30)37(34,35)27(26(33)28-3)12-14-31(15-13-27)25-11-6-22(2)21-29-25/h6-11,21H,4-5,12-20H2,1-3H3,(H,28,33)