N-(4-ethoxy-3-piperidin-1-ylsulfonyl-phenyl)-1-pyrazin-2-yl-piperidine-4-carboxamide

Systemtic Name: N-(4-ethoxy-3-piperidin-1-ylsulfonyl-phenyl)-1-pyrazin-2-yl-piperidine-4-carboxamide Openeye Name: N-[4-ethoxy-3-(1-piperidylsulfonyl)phenyl]-1-pyrazin-2-yl-piperidine-4-carboxamide CAS Name: N-[4-ethoxy-3-(1-piperidinylsulfonyl)phenyl]-1-(2-pyrazinyl)-4-piperidinecarboxamide IUPAC Name: N-(4-ethoxy-3-piperidin-1-ylsulfonylphenyl)-1-pyrazin-2-ylpiperidine-4-carboxamide Traditional Name: N-(4-ethoxy-3-piperidinosulfonyl-phenyl)-1-pyrazin-2-yl-isonipecotamide Formula: C23H31N5O4S MolecularWeight: 473.58834

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)C3=NC=CN=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)C3=NC=CN=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C23H31N5O4S/c1-2-32-20-7-6-19(16-21(20)33(30,31)28-12-4-3-5-13-28)26-23(29)18-8-14-27(15-9-18)22-17-24-10-11-25-22/h6-7,10-11,16-18H,2-5,8-9,12-15H2,1H3,(H,26,29)