N-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)-1-pyrazin-2-yl-piperidine-4-carboxamide

Systemtic Name: N-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)-1-pyrazin-2-yl-piperidine-4-carboxamide Openeye Name: N-[2-methoxy-5-(1-piperidylsulfonyl)phenyl]-1-pyrazin-2-yl-piperidine-4-carboxamide CAS Name: N-[2-methoxy-5-(1-piperidinylsulfonyl)phenyl]-1-(2-pyrazinyl)-4-piperidinecarboxamide IUPAC Name: N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-1-pyrazin-2-ylpiperidine-4-carboxamide Traditional Name: N-(2-methoxy-5-piperidinosulfonyl-phenyl)-1-pyrazin-2-yl-isonipecotamide Formula: C22H29N5O4S MolecularWeight: 459.56176

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3CCN(CC3)C4=NC=CN=C4

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3CCN(CC3)C4=NC=CN=C4

InChI

InChI=1S/C22H29N5O4S/c1-31-20-6-5-18(32(29,30)27-11-3-2-4-12-27)15-19(20)25-22(28)17-7-13-26(14-8-17)21-16-23-9-10-24-21/h5-6,9-10,15-17H,2-4,7-8,11-14H2,1H3,(H,25,28)