2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)sulfonylbenzenecarbonitrile

Systemtic Name: 2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)sulfonylbenzenecarbonitrile Openeye Name: 2-[4-(2-naphthylsulfonyl)piperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-(2-naphthalenylsulfonyl)-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)sulfonylbenzonitrile Traditional Name: 2-[4-(2-naphthylsulfonyl)piperazino]sulfonylbenzonitrile Formula: C21H19N3O4S2 MolecularWeight: 441.52326

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1S(=O)(=O)C2=CC3=CC=CC=C3C=C2)S(=O)(=O)C4=CC=CC=C4C#N

Isomeric SMILES

C1CN(CCN1S(=O)(=O)C2=CC3=CC=CC=C3C=C2)S(=O)(=O)C4=CC=CC=C4C#N

InChI

InChI=1S/C21H19N3O4S2/c22-16-19-7-3-4-8-21(19)30(27,28)24-13-11-23(12-14-24)29(25,26)20-10-9-17-5-1-2-6-18(17)15-20/h1-10,15H,11-14H2