(5-bromanyl-1H-indol-2-yl)-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (5-bromanyl-1H-indol-2-yl)-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (5-bromo-1H-indol-2-yl)-[4-(p-tolylsulfonyl)piperazin-1-yl]methanone CAS Name: (5-bromo-1H-indol-2-yl)-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (5-bromo-1H-indol-2-yl)-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (5-bromo-1H-indol-2-yl)-(4-tosylpiperazino)methanone Formula: C20H20BrN3O3S MolecularWeight: 462.3601

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=C(N3)C=CC(=C4)Br

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=C(N3)C=CC(=C4)Br

InChI

InChI=1S/C20H20BrN3O3S/c1-14-2-5-17(6-3-14)28(26,27)24-10-8-23(9-11-24)20(25)19-13-15-12-16(21)4-7-18(15)22-19/h2-7,12-13,22H,8-11H2,1H3