3-oxidanylidene-2-(phenylcarbonyl)-3-(1-phenyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)propanenitrile

Systemtic Name: 3-oxidanylidene-2-(phenylcarbonyl)-3-(1-phenyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)propanenitrile Openeye Name: 2-benzoyl-3-oxo-3-(1-phenyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)propanenitrile CAS Name: 2-benzoyl-3-oxo-3-(1-phenyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)propanenitrile IUPAC Name: 2-benzoyl-3-oxo-3-(1-phenyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)propanenitrile Traditional Name: 2-benzoyl-3-keto-3-(1-phenyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)propionitrile Formula: C26H17N3O2S MolecularWeight: 435.49708

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C3=CC=CC=C3S1)N(N=C2C(=O)C(C#N)C(=O)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1C2=C(C3=CC=CC=C3S1)N(N=C2C(=O)C(C#N)C(=O)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C26H17N3O2S/c27-15-20(25(30)17-9-3-1-4-10-17)26(31)23-21-16-32-22-14-8-7-13-19(22)24(21)29(28-23)18-11-5-2-6-12-18/h1-14,20H,16H2