[1-(4-propan-2-ylphenyl)sulfonylpiperidin-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: [1-(4-propan-2-ylphenyl)sulfonylpiperidin-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: [1-(4-isopropylphenyl)sulfonyl-4-piperidyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: [1-(4-propan-2-ylphenyl)sulfonyl-4-piperidinyl]-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: [1-(4-propan-2-ylphenyl)sulfonylpiperidin-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: (1-p-cumenylsulfonyl-4-piperidyl)-[4-(2-pyrimidyl)piperazino]methanone Formula: C23H31N5O3S MolecularWeight: 457.58894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C23H31N5O3S/c1-18(2)19-4-6-21(7-5-19)32(30,31)28-12-8-20(9-13-28)22(29)26-14-16-27(17-15-26)23-24-10-3-11-25-23/h3-7,10-11,18,20H,8-9,12-17H2,1-2H3