N-[3,5-dimethyl-1-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]pyrazol-4-yl]-N-methylsulfonyl-methanesulfonamide

Systemtic Name: N-[3,5-dimethyl-1-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]pyrazol-4-yl]-N-methylsulfonyl-methanesulfonamide Openeye Name: N-[3,5-dimethyl-1-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]pyrazol-4-yl]-N-methylsulfonyl-methanesulfonamide CAS Name: N-[3,5-dimethyl-1-[4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl]-4-pyrazolyl]-N-methylsulfonylmethanesulfonamide IUPAC Name: N-[3,5-dimethyl-1-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]pyrazol-4-yl]-N-methylsulfonylmethanesulfonamide Traditional Name: N-[3,5-dimethyl-1-[4-[4-(2-pyrimidyl)piperazino]butyl]pyrazol-4-yl]-N-mesyl-methanesulfonamide Formula: C19H31N7O4S2 MolecularWeight: 485.62394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCCCN2CCN(CC2)C3=NC=CC=N3)C)N(S(=O)(=O)C)S(=O)(=O)C

Isomeric SMILES

CC1=C(C(=NN1CCCCN2CCN(CC2)C3=NC=CC=N3)C)N(S(=O)(=O)C)S(=O)(=O)C

InChI

InChI=1S/C19H31N7O4S2/c1-16-18(26(31(3,27)28)32(4,29)30)17(2)25(22-16)11-6-5-10-23-12-14-24(15-13-23)19-20-8-7-9-21-19/h7-9H,5-6,10-15H2,1-4H3