2-[2-(1,2-dimethyl-3-oxidanylidene-5-quinoxalin-6-yl-pyrazol-4-yl)phenyl]ethanenitrile

Systemtic Name: 2-[2-(1,2-dimethyl-3-oxidanylidene-5-quinoxalin-6-yl-pyrazol-4-yl)phenyl]ethanenitrile Openeye Name: 2-[2-(1,2-dimethyl-3-oxo-5-quinoxalin-6-yl-pyrazol-4-yl)phenyl]acetonitrile CAS Name: 2-[2-[1,2-dimethyl-3-oxo-5-(6-quinoxalinyl)-4-pyrazolyl]phenyl]acetonitrile IUPAC Name: 2-[2-(1,2-dimethyl-3-oxo-5-quinoxalin-6-ylpyrazol-4-yl)phenyl]acetonitrile Traditional Name: 2-[2-(3-keto-1,2-dimethyl-5-quinoxalin-6-yl-3-pyrazolin-4-yl)phenyl]acetonitrile Formula: C21H17N5O MolecularWeight: 355.39258

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N1C)C2=CC=CC=C2CC#N)C3=CC4=NC=CN=C4C=C3

Isomeric SMILES

CN1C(=C(C(=O)N1C)C2=CC=CC=C2CC#N)C3=CC4=NC=CN=C4C=C3

InChI

InChI=1S/C21H17N5O/c1-25-20(15-7-8-17-18(13-15)24-12-11-23-17)19(21(27)26(25)2)16-6-4-3-5-14(16)9-10-22/h3-8,11-13H,9H2,1-2H3