[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-[1-(6-chloranylpyrimidin-4-yl)piperidin-4-yl]methanone

Systemtic Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-[1-(6-chloranylpyrimidin-4-yl)piperidin-4-yl]methanone Openeye Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-[1-(6-chloropyrimidin-4-yl)-4-piperidyl]methanone CAS Name: [4-(4-bromophenyl)sulfonyl-1-piperazinyl]-[1-(6-chloro-4-pyrimidinyl)-4-piperidinyl]methanone IUPAC Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-[1-(6-chloropyrimidin-4-yl)piperidin-4-yl]methanone Traditional Name: (4-brosylpiperazino)-[1-(6-chloropyrimidin-4-yl)-4-piperidyl]methanone Formula: C20H23BrClN5O3S MolecularWeight: 528.85032

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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=CC(=NC=N4)Cl

Isomeric SMILES

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

InChI

InChI=1S/C20H23BrClN5O3S/c21-16-1-3-17(4-2-16)31(29,30)27-11-9-26(10-12-27)20(28)15-5-7-25(8-6-15)19-13-18(22)23-14-24-19/h1-4,13-15H,5-12H2