2-[2-oxidanylidene-2-[3-thiophen-2-yl-7-(thiophen-2-ylmethylidene)-3a,4,5,6-tetrahydro-3H-indazol-2-yl]ethoxy]benzenecarbonitrile

Systemtic Name: 2-[2-oxidanylidene-2-[3-thiophen-2-yl-7-(thiophen-2-ylmethylidene)-3a,4,5,6-tetrahydro-3H-indazol-2-yl]ethoxy]benzenecarbonitrile Openeye Name: 2-[2-oxo-2-[3-(2-thienyl)-7-(2-thienylmethylene)-3a,4,5,6-tetrahydro-3H-indazol-2-yl]ethoxy]benzonitrile CAS Name: 2-[2-oxo-2-[3-thiophen-2-yl-7-(thiophen-2-ylmethylidene)-3a,4,5,6-tetrahydro-3H-indazol-2-yl]ethoxy]benzonitrile IUPAC Name: 2-[2-oxo-2-[3-thiophen-2-yl-7-(thiophen-2-ylmethylidene)-3a,4,5,6-tetrahydro-3H-indazol-2-yl]ethoxy]benzonitrile Traditional Name: 2-[2-keto-2-[7-(2-thenylidene)-3-(2-thienyl)-3a,4,5,6-tetrahydro-3H-indazol-2-yl]ethoxy]benzonitrile Formula: C25H21N3O2S2 MolecularWeight: 459.58314

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2C(N(N=C2C(=CC3=CC=CS3)C1)C(=O)COC4=CC=CC=C4C#N)C5=CC=CS5

Isomeric SMILES

C1CC2C(N(N=C2C(=CC3=CC=CS3)C1)C(=O)COC4=CC=CC=C4C#N)C5=CC=CS5

InChI

InChI=1S/C25H21N3O2S2/c26-15-18-6-1-2-10-21(18)30-16-23(29)28-25(22-11-5-13-32-22)20-9-3-7-17(24(20)27-28)14-19-8-4-12-31-19/h1-2,4-6,8,10-14,20,25H,3,7,9,16H2