[1-(phenylsulfonyl)piperidin-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: [1-(phenylsulfonyl)piperidin-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: [1-(benzenesulfonyl)-4-piperidyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: [1-(benzenesulfonyl)-4-piperidinyl]-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: [1-(benzenesulfonyl)piperidin-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: (1-besyl-4-piperidyl)-[4-(2-pyrimidyl)piperazino]methanone Formula: C20H25N5O3S MolecularWeight: 415.5092

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CCN(CC2)C3=NC=CC=N3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)N2CCN(CC2)C3=NC=CC=N3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C20H25N5O3S/c26-19(23-13-15-24(16-14-23)20-21-9-4-10-22-20)17-7-11-25(12-8-17)29(27,28)18-5-2-1-3-6-18/h1-6,9-10,17H,7-8,11-16H2