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

Systemtic Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-[1-(2-chloranyl-1-pyrimidin-4-yl-piperidin-4-yl)piperidin-4-yl]methanone Openeye Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-[1-(2-chloro-1-pyrimidin-4-yl-4-piperidyl)-4-piperidyl]methanone CAS Name: [4-(4-bromophenyl)sulfonyl-1-piperazinyl]-[1-[2-chloro-1-(4-pyrimidinyl)-4-piperidinyl]-4-piperidinyl]methanone IUPAC Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-[1-(2-chloro-1-pyrimidin-4-ylpiperidin-4-yl)piperidin-4-yl]methanone Traditional Name: (4-brosylpiperazino)-[1-[2-chloro-1-(4-pyrimidyl)-4-piperidyl]-4-piperidyl]methanone Formula: C25H32BrClN6O3S MolecularWeight: 611.98198

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Br)C4CCN(C(C4)Cl)C5=NC=NC=C5

Isomeric SMILES

C1CN(CCC1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Br)C4CCN(C(C4)Cl)C5=NC=NC=C5

InChI

InChI=1S/C25H32BrClN6O3S/c26-20-1-3-22(4-2-20)37(35,36)32-15-13-31(14-16-32)25(34)19-6-10-30(11-7-19)21-8-12-33(23(27)17-21)24-5-9-28-18-29-24/h1-5,9,18-19,21,23H,6-8,10-17H2