2-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-4-methyl-6-piperidin-1-yl-pyrimidine

Systemtic Name: 2-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-4-methyl-6-piperidin-1-yl-pyrimidine Openeye Name: 2-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-4-methyl-6-(1-piperidyl)pyrimidine CAS Name: 2-[4-(4-bromophenyl)sulfonyl-1-piperazinyl]-4-methyl-6-(1-piperidinyl)pyrimidine IUPAC Name: 2-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-4-methyl-6-piperidin-1-ylpyrimidine Traditional Name: 2-(4-brosylpiperazino)-4-methyl-6-piperidino-pyrimidine Formula: C20H26BrN5O2S MolecularWeight: 480.42174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Br)N4CCCCC4

Isomeric SMILES

CC1=CC(=NC(=N1)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Br)N4CCCCC4

InChI

InChI=1S/C20H26BrN5O2S/c1-16-15-19(24-9-3-2-4-10-24)23-20(22-16)25-11-13-26(14-12-25)29(27,28)18-7-5-17(21)6-8-18/h5-8,15H,2-4,9-14H2,1H3