5-bromanyl-3-[(4-methylpiperazin-1-yl)methyl]-2-(phenylsulfonylmethyl)-1H-indole

Systemtic Name: 5-bromanyl-3-[(4-methylpiperazin-1-yl)methyl]-2-(phenylsulfonylmethyl)-1H-indole Openeye Name: 2-(benzenesulfonylmethyl)-5-bromo-3-[(4-methylpiperazin-1-yl)methyl]-1H-indole CAS Name: 2-(benzenesulfonylmethyl)-5-bromo-3-[(4-methyl-1-piperazinyl)methyl]-1H-indole IUPAC Name: 2-(benzenesulfonylmethyl)-5-bromo-3-[(4-methylpiperazin-1-yl)methyl]-1H-indole Traditional Name: 2-(besylmethyl)-5-bromo-3-[(4-methylpiperazino)methyl]-1H-indole Formula: C21H24BrN3O2S MolecularWeight: 462.40316

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=C(NC3=C2C=C(C=C3)Br)CS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CN1CCN(CC1)CC2=C(NC3=C2C=C(C=C3)Br)CS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H24BrN3O2S/c1-24-9-11-25(12-10-24)14-19-18-13-16(22)7-8-20(18)23-21(19)15-28(26,27)17-5-3-2-4-6-17/h2-8,13,23H,9-12,14-15H2,1H3