[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-[1-(2-ethylpyrimidin-4-yl)-4-methyl-piperidin-4-yl]methanone

Systemtic Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-[1-(2-ethylpyrimidin-4-yl)-4-methyl-piperidin-4-yl]methanone Openeye Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-[1-(2-ethylpyrimidin-4-yl)-4-methyl-4-piperidyl]methanone CAS Name: [4-(4-bromophenyl)sulfonyl-1-piperazinyl]-[1-(2-ethyl-4-pyrimidinyl)-4-methyl-4-piperidinyl]methanone IUPAC Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-[1-(2-ethylpyrimidin-4-yl)-4-methylpiperidin-4-yl]methanone Traditional Name: (4-brosylpiperazino)-[1-(2-ethylpyrimidin-4-yl)-4-methyl-4-piperidyl]methanone Formula: C23H30BrN5O3S MolecularWeight: 536.485

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC=CC(=N1)N2CCC(CC2)(C)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CCC1=NC=CC(=N1)N2CCC(CC2)(C)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C23H30BrN5O3S/c1-3-20-25-11-8-21(26-20)27-12-9-23(2,10-13-27)22(30)28-14-16-29(17-15-28)33(31,32)19-6-4-18(24)5-7-19/h4-8,11H,3,9-10,12-17H2,1-2H3