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

Systemtic Name: 3-oxidanylidene-2-(phenylsulfonyl)-3-(1-phenyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)propanenitrile Openeye Name: 2-(benzenesulfonyl)-3-oxo-3-(1-phenyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)propanenitrile CAS Name: 2-(benzenesulfonyl)-3-oxo-3-(1-phenyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)propanenitrile IUPAC Name: 2-(benzenesulfonyl)-3-oxo-3-(1-phenyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)propanenitrile Traditional Name: 2-besyl-3-keto-3-(1-phenyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)propionitrile Formula: C25H17N3O3S2 MolecularWeight: 471.55078

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H17N3O3S2/c26-15-22(33(30,31)18-11-5-2-6-12-18)25(29)23-20-16-32-21-14-8-7-13-19(21)24(20)28(27-23)17-9-3-1-4-10-17/h1-14,22H,16H2