4-[4-[6-(4-methylpiperidin-1-yl)pyrimidin-4-yl]piperazin-1-yl]carbonylbenzenesulfonamide

Systemtic Name: 4-[4-[6-(4-methylpiperidin-1-yl)pyrimidin-4-yl]piperazin-1-yl]carbonylbenzenesulfonamide Openeye Name: 4-[4-[6-(4-methyl-1-piperidyl)pyrimidin-4-yl]piperazine-1-carbonyl]benzenesulfonamide CAS Name: 4-[[4-[6-(4-methyl-1-piperidinyl)-4-pyrimidinyl]-1-piperazinyl]-oxomethyl]benzenesulfonamide IUPAC Name: 4-[4-[6-(4-methylpiperidin-1-yl)pyrimidin-4-yl]piperazine-1-carbonyl]benzenesulfonamide Traditional Name: 4-[4-[6-(4-methylpiperidino)pyrimidin-4-yl]piperazine-1-carbonyl]benzenesulfonamide Formula: C21H28N6O3S MolecularWeight: 444.55042

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=CC(=NC=N2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

CC1CCN(CC1)C2=CC(=NC=N2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C21H28N6O3S/c1-16-6-8-25(9-7-16)19-14-20(24-15-23-19)26-10-12-27(13-11-26)21(28)17-2-4-18(5-3-17)31(22,29)30/h2-5,14-16H,6-13H2,1H3,(H2,22,29,30)