4-[4-(3-bromophenyl)sulfonylpiperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 4-[4-(3-bromophenyl)sulfonylpiperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 4-[4-(3-bromophenyl)sulfonylpiperazin-1-yl]sulfonylbenzonitrile CAS Name: 4-[[4-(3-bromophenyl)sulfonyl-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 4-[4-(3-bromophenyl)sulfonylpiperazin-1-yl]sulfonylbenzonitrile Traditional Name: 4-[4-(3-bromophenyl)sulfonylpiperazino]sulfonylbenzonitrile Formula: C17H16BrN3O4S2 MolecularWeight: 470.36064

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1S(=O)(=O)C2=CC=C(C=C2)C#N)S(=O)(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

C1CN(CCN1S(=O)(=O)C2=CC=C(C=C2)C#N)S(=O)(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C17H16BrN3O4S2/c18-15-2-1-3-17(12-15)27(24,25)21-10-8-20(9-11-21)26(22,23)16-6-4-14(13-19)5-7-16/h1-7,12H,8-11H2