2-[4-[[4-[4-(2-cyanophenyl)sulfonylpiperazin-1-yl]sulfonyl-1H-pyrrol-2-yl]carbonyl]piperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-[[4-[4-(2-cyanophenyl)sulfonylpiperazin-1-yl]sulfonyl-1H-pyrrol-2-yl]carbonyl]piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-[4-[4-(2-cyanophenyl)sulfonylpiperazin-1-yl]sulfonyl-1H-pyrrole-2-carbonyl]piperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-[[4-[[4-(2-cyanophenyl)sulfonyl-1-piperazinyl]sulfonyl]-1H-pyrrol-2-yl]-oxomethyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-[4-[4-(2-cyanophenyl)sulfonylpiperazin-1-yl]sulfonyl-1H-pyrrole-2-carbonyl]piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-[4-[4-(2-cyanophenyl)sulfonylpiperazino]sulfonyl-1H-pyrrole-2-carbonyl]piperazino]sulfonylbenzonitrile Formula: C27H27N7O7S3 MolecularWeight: 657.74098

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC(=CN2)S(=O)(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C#N)S(=O)(=O)C5=CC=CC=C5C#N

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC(=CN2)S(=O)(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C#N)S(=O)(=O)C5=CC=CC=C5C#N

InChI

InChI=1S/C27H27N7O7S3/c28-18-21-5-1-3-7-25(21)43(38,39)33-11-9-31(10-12-33)27(35)24-17-23(20-30-24)42(36,37)32-13-15-34(16-14-32)44(40,41)26-8-4-2-6-22(26)19-29/h1-8,17,20,30H,9-16H2