8-[4-[(4-bromophenyl)methyl]piperazin-1-yl]sulfonyl-3-methyl-quinoline

Systemtic Name: 8-[4-[(4-bromophenyl)methyl]piperazin-1-yl]sulfonyl-3-methyl-quinoline Openeye Name: 8-[4-[(4-bromophenyl)methyl]piperazin-1-yl]sulfonyl-3-methyl-quinoline CAS Name: 8-[[4-[(4-bromophenyl)methyl]-1-piperazinyl]sulfonyl]-3-methylquinoline IUPAC Name: 8-[4-[(4-bromophenyl)methyl]piperazin-1-yl]sulfonyl-3-methylquinoline Traditional Name: 8-[4-(4-bromobenzyl)piperazino]sulfonyl-3-methyl-quinoline Formula: C21H22BrN3O2S MolecularWeight: 460.38728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)N3CCN(CC3)CC4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)N3CCN(CC3)CC4=CC=C(C=C4)Br

InChI

InChI=1S/C21H22BrN3O2S/c1-16-13-18-3-2-4-20(21(18)23-14-16)28(26,27)25-11-9-24(10-12-25)15-17-5-7-19(22)8-6-17/h2-8,13-14H,9-12,15H2,1H3