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

Systemtic Name: 4-[[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-piperidin-4-yl-methyl]-2,6-dimethyl-pyrimidine Openeye Name: 4-[[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-(4-piperidyl)methyl]-2,6-dimethyl-pyrimidine CAS Name: 4-[[4-(4-bromophenyl)sulfonyl-1-piperazinyl]-(4-piperidinyl)methyl]-2,6-dimethylpyrimidine IUPAC Name: 4-[[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-piperidin-4-ylmethyl]-2,6-dimethylpyrimidine Traditional Name: 4-[(4-brosylpiperazino)-(4-piperidyl)methyl]-2,6-dimethyl-pyrimidine Formula: C22H30BrN5O2S MolecularWeight: 508.4749

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C)C(C2CCNCC2)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC(=NC(=N1)C)C(C2CCNCC2)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H30BrN5O2S/c1-16-15-21(26-17(2)25-16)22(18-7-9-24-10-8-18)27-11-13-28(14-12-27)31(29,30)20-5-3-19(23)4-6-20/h3-6,15,18,22,24H,7-14H2,1-2H3