N-methyl-4-[2-(phenylsulfonyl)ethyl]-1-pyridin-4-ylcarbonyl-piperazine-2-carboxamide

Systemtic Name: N-methyl-4-[2-(phenylsulfonyl)ethyl]-1-pyridin-4-ylcarbonyl-piperazine-2-carboxamide Openeye Name: 4-[2-(benzenesulfonyl)ethyl]-N-methyl-1-(pyridine-4-carbonyl)piperazine-2-carboxamide CAS Name: 4-[2-(benzenesulfonyl)ethyl]-N-methyl-1-[oxo(pyridin-4-yl)methyl]-2-piperazinecarboxamide IUPAC Name: 4-[2-(benzenesulfonyl)ethyl]-N-methyl-1-(pyridine-4-carbonyl)piperazine-2-carboxamide Traditional Name: 4-(2-besylethyl)-1-isonicotinoyl-N-methyl-piperazine-2-carboxamide Formula: C20H24N4O4S MolecularWeight: 416.49396

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1CN(CCN1C(=O)C2=CC=NC=C2)CCS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CNC(=O)C1CN(CCN1C(=O)C2=CC=NC=C2)CCS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H24N4O4S/c1-21-19(25)18-15-23(13-14-29(27,28)17-5-3-2-4-6-17)11-12-24(18)20(26)16-7-9-22-10-8-16/h2-10,18H,11-15H2,1H3,(H,21,25)