3-oxidanylidene-1,4-diphenyl-6-sulfanylidene-2,3a,4,5,7,7a-hexahydropyrazolo[3,4-b]pyridine-5-carbonitrile

Systemtic Name: 3-oxidanylidene-1,4-diphenyl-6-sulfanylidene-2,3a,4,5,7,7a-hexahydropyrazolo[3,4-b]pyridine-5-carbonitrile Openeye Name: 3-oxo-1,4-diphenyl-6-thioxo-2,3a,4,5,7,7a-hexahydropyrazolo[3,4-b]pyridine-5-carbonitrile CAS Name: 3-oxo-1,4-diphenyl-6-sulfanylidene-2,3a,4,5,7,7a-hexahydropyrazolo[3,4-b]pyridine-5-carbonitrile IUPAC Name: 3-oxo-1,4-diphenyl-6-sulfanylidene-2,3a,4,5,7,7a-hexahydropyrazolo[3,4-b]pyridine-5-carbonitrile Traditional Name: 3-keto-1,4-diphenyl-6-thioxo-2,3a,4,5,7,7a-hexahydropyrazolo[3,4-b]pyridine-5-carbonitrile Formula: C19H16N4OS MolecularWeight: 348.42154

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C(C(=S)NC3C2C(=O)NN3C4=CC=CC=C4)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2C(C(=S)NC3C2C(=O)NN3C4=CC=CC=C4)C#N

InChI

InChI=1S/C19H16N4OS/c20-11-14-15(12-7-3-1-4-8-12)16-17(21-19(14)25)23(22-18(16)24)13-9-5-2-6-10-13/h1-10,14-17H,(H,21,25)(H,22,24)