4-(5-cyanopyridin-2-yl)-N-[6-(hydroxymethyl)pyridin-2-yl]-2-methyl-piperazine-1-sulfonamide

Systemtic Name: 4-(5-cyanopyridin-2-yl)-N-[6-(hydroxymethyl)pyridin-2-yl]-2-methyl-piperazine-1-sulfonamide Openeye Name: 4-(5-cyano-2-pyridyl)-N-[6-(hydroxymethyl)-2-pyridyl]-2-methyl-piperazine-1-sulfonamide CAS Name: 4-(5-cyano-2-pyridinyl)-N-[6-(hydroxymethyl)-2-pyridinyl]-2-methyl-1-piperazinesulfonamide IUPAC Name: 4-(5-cyanopyridin-2-yl)-N-[6-(hydroxymethyl)pyridin-2-yl]-2-methylpiperazine-1-sulfonamide Traditional Name: 4-(5-cyano-2-pyridyl)-2-methyl-N-(6-methylol-2-pyridyl)piperazine-1-sulfonamide Formula: C17H20N6O3S MolecularWeight: 388.4441

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1S(=O)(=O)NC2=CC=CC(=N2)CO)C3=NC=C(C=C3)C#N

Isomeric SMILES

CC1CN(CCN1S(=O)(=O)NC2=CC=CC(=N2)CO)C3=NC=C(C=C3)C#N

InChI

InChI=1S/C17H20N6O3S/c1-13-11-22(17-6-5-14(9-18)10-19-17)7-8-23(13)27(25,26)21-16-4-2-3-15(12-24)20-16/h2-6,10,13,24H,7-8,11-12H2,1H3,(H,20,21)