[1-[5-(4-methylsulfonylphenyl)pyrimidin-2-yl]piperidin-4-yl]-(4-propan-2-ylpiperazin-1-yl)methanone

Systemtic Name: [1-[5-(4-methylsulfonylphenyl)pyrimidin-2-yl]piperidin-4-yl]-(4-propan-2-ylpiperazin-1-yl)methanone Openeye Name: (4-isopropylpiperazin-1-yl)-[1-[5-(4-methylsulfonylphenyl)pyrimidin-2-yl]-4-piperidyl]methanone CAS Name: [1-[5-(4-methylsulfonylphenyl)-2-pyrimidinyl]-4-piperidinyl]-(4-propan-2-yl-1-piperazinyl)methanone IUPAC Name: [1-[5-(4-methylsulfonylphenyl)pyrimidin-2-yl]piperidin-4-yl]-(4-propan-2-ylpiperazin-1-yl)methanone Traditional Name: (4-isopropylpiperazino)-[1-[5-(4-mesylphenyl)pyrimidin-2-yl]-4-piperidyl]methanone Formula: C24H33N5O3S MolecularWeight: 471.61552

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCN(CC1)C(=O)C2CCN(CC2)C3=NC=C(C=N3)C4=CC=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CC(C)N1CCN(CC1)C(=O)C2CCN(CC2)C3=NC=C(C=N3)C4=CC=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C24H33N5O3S/c1-18(2)27-12-14-28(15-13-27)23(30)20-8-10-29(11-9-20)24-25-16-21(17-26-24)19-4-6-22(7-5-19)33(3,31)32/h4-7,16-18,20H,8-15H2,1-3H3