8-[[4-(4-bromophenyl)sulfonylpiperazin-1-yl]methyl]quinoline

Systemtic Name: 8-[[4-(4-bromophenyl)sulfonylpiperazin-1-yl]methyl]quinoline Openeye Name: 8-[[4-(4-bromophenyl)sulfonylpiperazin-1-yl]methyl]quinoline CAS Name: 8-[[4-(4-bromophenyl)sulfonyl-1-piperazinyl]methyl]quinoline IUPAC Name: 8-[[4-(4-bromophenyl)sulfonylpiperazin-1-yl]methyl]quinoline Traditional Name: 8-[(4-brosylpiperazino)methyl]quinoline Formula: C20H20BrN3O2S MolecularWeight: 446.3607

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC3=C2N=CC=C3)S(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CN(CCN1CC2=CC=CC3=C2N=CC=C3)S(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C20H20BrN3O2S/c21-18-6-8-19(9-7-18)27(25,26)24-13-11-23(12-14-24)15-17-4-1-3-16-5-2-10-22-20(16)17/h1-10H,11-15H2