[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-(1-pyrimidin-2-ylpiperidin-4-yl)methanone

Systemtic Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-(1-pyrimidin-2-ylpiperidin-4-yl)methanone Openeye Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-(1-pyrimidin-2-yl-4-piperidyl)methanone CAS Name: [4-(4-bromophenyl)sulfonyl-1-piperazinyl]-[1-(2-pyrimidinyl)-4-piperidinyl]methanone IUPAC Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-(1-pyrimidin-2-ylpiperidin-4-yl)methanone Traditional Name: (4-brosylpiperazino)-[1-(2-pyrimidyl)-4-piperidyl]methanone Formula: C20H24BrN5O3S MolecularWeight: 494.40526

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Br)C4=NC=CC=N4

Isomeric SMILES

C1CN(CCC1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Br)C4=NC=CC=N4

InChI

InChI=1S/C20H24BrN5O3S/c21-17-2-4-18(5-3-17)30(28,29)26-14-12-24(13-15-26)19(27)16-6-10-25(11-7-16)20-22-8-1-9-23-20/h1-5,8-9,16H,6-7,10-15H2