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

Systemtic Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-[1-(6-methylpyrimidin-4-yl)piperidin-4-yl]methanone Openeye Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-[1-(6-methylpyrimidin-4-yl)-4-piperidyl]methanone CAS Name: [4-(4-bromophenyl)sulfonyl-1-piperazinyl]-[1-(6-methyl-4-pyrimidinyl)-4-piperidinyl]methanone IUPAC Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-[1-(6-methylpyrimidin-4-yl)piperidin-4-yl]methanone Traditional Name: (4-brosylpiperazino)-[1-(6-methylpyrimidin-4-yl)-4-piperidyl]methanone Formula: C21H26BrN5O3S MolecularWeight: 508.43184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=N1)N2CCC(CC2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC(=NC=N1)N2CCC(CC2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H26BrN5O3S/c1-16-14-20(24-15-23-16)25-8-6-17(7-9-25)21(28)26-10-12-27(13-11-26)31(29,30)19-4-2-18(22)3-5-19/h2-5,14-15,17H,6-13H2,1H3