3-(4-naphthalen-2-ylcarbonylpiperazin-1-yl)sulfonylbenzenecarbonitrile

Systemtic Name: 3-(4-naphthalen-2-ylcarbonylpiperazin-1-yl)sulfonylbenzenecarbonitrile Openeye Name: 3-[4-(naphthalene-2-carbonyl)piperazin-1-yl]sulfonylbenzonitrile CAS Name: 3-[[4-[2-naphthalenyl(oxo)methyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 3-[4-(naphthalene-2-carbonyl)piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 3-[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=CC(=C4)C#N

Isomeric SMILES

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

InChI

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