4-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]-N-(phenylsulfonyl)piperazine-1-carboxamide

Systemtic Name: 4-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]-N-(phenylsulfonyl)piperazine-1-carboxamide Openeye Name: N-(benzenesulfonyl)-4-[1-(4,6-dimethylpyrimidin-2-yl)-4-piperidyl]piperazine-1-carboxamide CAS Name: N-(benzenesulfonyl)-4-[1-(4,6-dimethyl-2-pyrimidinyl)-4-piperidinyl]-1-piperazinecarboxamide IUPAC Name: N-(benzenesulfonyl)-4-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]piperazine-1-carboxamide Traditional Name: N-besyl-4-[1-(4,6-dimethylpyrimidin-2-yl)-4-piperidyl]piperazine-1-carboxamide Formula: C22H30N6O3S MolecularWeight: 458.577

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2CCC(CC2)N3CCN(CC3)C(=O)NS(=O)(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=NC(=N1)N2CCC(CC2)N3CCN(CC3)C(=O)NS(=O)(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C22H30N6O3S/c1-17-16-18(2)24-21(23-17)27-10-8-19(9-11-27)26-12-14-28(15-13-26)22(29)25-32(30,31)20-6-4-3-5-7-20/h3-7,16,19H,8-15H2,1-2H3,(H,25,29)