3-(1,3-diphenylthieno[2,3-c]pyrazol-5-yl)-3-oxidanylidene-2-quinolin-2-yl-propanenitrile

Systemtic Name: 3-(1,3-diphenylthieno[2,3-c]pyrazol-5-yl)-3-oxidanylidene-2-quinolin-2-yl-propanenitrile Openeye Name: 3-(1,3-diphenylthieno[2,3-c]pyrazol-5-yl)-3-oxo-2-(2-quinolyl)propanenitrile CAS Name: 3-(1,3-diphenyl-5-thieno[2,3-c]pyrazolyl)-3-oxo-2-(2-quinolinyl)propanenitrile IUPAC Name: 3-(1,3-diphenylthieno[2,3-c]pyrazol-5-yl)-3-oxo-2-quinolin-2-ylpropanenitrile Traditional Name: 3-(1,3-diphenylthieno[2,3-c]pyrazol-5-yl)-3-keto-2-(2-quinolyl)propionitrile Formula: C29H18N4OS MolecularWeight: 470.54442

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C3=C2C=C(S3)C(=O)C(C#N)C4=NC5=CC=CC=C5C=C4)C6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C3=C2C=C(S3)C(=O)C(C#N)C4=NC5=CC=CC=C5C=C4)C6=CC=CC=C6

InChI

InChI=1S/C29H18N4OS/c30-18-23(25-16-15-19-9-7-8-14-24(19)31-25)28(34)26-17-22-27(20-10-3-1-4-11-20)32-33(29(22)35-26)21-12-5-2-6-13-21/h1-17,23H