N-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]-1-pyrazin-2-yl-piperidine-3-carboxamide

Systemtic Name: N-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]-1-pyrazin-2-yl-piperidine-3-carboxamide Openeye Name: N-[1-(4-methoxyphenyl)sulfonyl-4-piperidyl]-1-pyrazin-2-yl-piperidine-3-carboxamide CAS Name: N-[1-(4-methoxyphenyl)sulfonyl-4-piperidinyl]-1-(2-pyrazinyl)-3-piperidinecarboxamide IUPAC Name: N-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]-1-pyrazin-2-ylpiperidine-3-carboxamide Traditional Name: N-[1-(4-methoxyphenyl)sulfonyl-4-piperidyl]-1-pyrazin-2-yl-nipecotamide Formula: C22H29N5O4S MolecularWeight: 459.56176

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NC(=O)C3CCCN(C3)C4=NC=CN=C4

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NC(=O)C3CCCN(C3)C4=NC=CN=C4

InChI

InChI=1S/C22H29N5O4S/c1-31-19-4-6-20(7-5-19)32(29,30)27-13-8-18(9-14-27)25-22(28)17-3-2-12-26(16-17)21-15-23-10-11-24-21/h4-7,10-11,15,17-18H,2-3,8-9,12-14,16H2,1H3,(H,25,28)