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

Systemtic Name: 4-(4-naphthalen-2-ylcarbonylpiperazin-1-yl)sulfonylbenzenecarbonitrile Openeye Name: 4-[4-(naphthalene-2-carbonyl)piperazin-1-yl]sulfonylbenzonitrile CAS Name: 4-[[4-[2-naphthalenyl(oxo)methyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 4-[4-(naphthalene-2-carbonyl)piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 4-[4-(2-naphthoyl)piperazino]sulfonylbenzonitrile Formula: C22H19N3O3S MolecularWeight: 405.46956

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC3=CC=CC=C3C=C2)S(=O)(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC3=CC=CC=C3C=C2)S(=O)(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C22H19N3O3S/c23-16-17-5-9-21(10-6-17)29(27,28)25-13-11-24(12-14-25)22(26)20-8-7-18-3-1-2-4-19(18)15-20/h1-10,15H,11-14H2