1-(4-bromophenyl)sulfonyl-3-[(4-methylpiperazin-1-yl)methyl]indole-5-carbonitrile

Systemtic Name: 1-(4-bromophenyl)sulfonyl-3-[(4-methylpiperazin-1-yl)methyl]indole-5-carbonitrile Openeye Name: 1-(4-bromophenyl)sulfonyl-3-[(4-methylpiperazin-1-yl)methyl]indole-5-carbonitrile CAS Name: 1-(4-bromophenyl)sulfonyl-3-[(4-methyl-1-piperazinyl)methyl]-5-indolecarbonitrile IUPAC Name: 1-(4-bromophenyl)sulfonyl-3-[(4-methylpiperazin-1-yl)methyl]indole-5-carbonitrile Traditional Name: 1-brosyl-3-[(4-methylpiperazino)methyl]indole-5-carbonitrile Formula: C21H21BrN4O2S MolecularWeight: 473.38604

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=CN(C3=C2C=C(C=C3)C#N)S(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CN1CCN(CC1)CC2=CN(C3=C2C=C(C=C3)C#N)S(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H21BrN4O2S/c1-24-8-10-25(11-9-24)14-17-15-26(21-7-2-16(13-23)12-20(17)21)29(27,28)19-5-3-18(22)4-6-19/h2-7,12,15H,8-11,14H2,1H3