3-(3-quinolin-4-ylpyrazol-1-yl)sulfonylbenzenecarbonitrile

Systemtic Name: 3-(3-quinolin-4-ylpyrazol-1-yl)sulfonylbenzenecarbonitrile Openeye Name: 3-[3-(4-quinolyl)pyrazol-1-yl]sulfonylbenzonitrile CAS Name: 3-[[3-(4-quinolinyl)-1-pyrazolyl]sulfonyl]benzonitrile IUPAC Name: 3-(3-quinolin-4-ylpyrazol-1-yl)sulfonylbenzonitrile Traditional Name: 3-[3-(4-quinolyl)pyrazol-1-yl]sulfonylbenzonitrile Formula: C19H12N4O2S MolecularWeight: 360.38918

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC=N2)C3=NN(C=C3)S(=O)(=O)C4=CC=CC(=C4)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC=N2)C3=NN(C=C3)S(=O)(=O)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C19H12N4O2S/c20-13-14-4-3-5-15(12-14)26(24,25)23-11-9-19(22-23)17-8-10-21-18-7-2-1-6-16(17)18/h1-12H