2-(1H-benzimidazol-2-ylsulfanyl)-1-[3-thiophen-2-yl-7-(thiophen-2-ylmethylidene)-3a,4,5,6-tetrahydro-3H-indazol-2-yl]ethanone

Systemtic Name: 2-(1H-benzimidazol-2-ylsulfanyl)-1-[3-thiophen-2-yl-7-(thiophen-2-ylmethylidene)-3a,4,5,6-tetrahydro-3H-indazol-2-yl]ethanone Openeye Name: 2-(1H-benzimidazol-2-ylsulfanyl)-1-[3-(2-thienyl)-7-(2-thienylmethylene)-3a,4,5,6-tetrahydro-3H-indazol-2-yl]ethanone CAS Name: 2-(1H-benzimidazol-2-ylthio)-1-[3-thiophen-2-yl-7-(thiophen-2-ylmethylidene)-3a,4,5,6-tetrahydro-3H-indazol-2-yl]ethanone IUPAC Name: 2-(1H-benzimidazol-2-ylsulfanyl)-1-[3-thiophen-2-yl-7-(thiophen-2-ylmethylidene)-3a,4,5,6-tetrahydro-3H-indazol-2-yl]ethanone Traditional Name: 2-(1H-benzimidazol-2-ylthio)-1-[7-(2-thenylidene)-3-(2-thienyl)-3a,4,5,6-tetrahydro-3H-indazol-2-yl]ethanone Formula: C25H22N4OS3 MolecularWeight: 490.66338

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2C(N(N=C2C(=CC3=CC=CS3)C1)C(=O)CSC4=NC5=CC=CC=C5N4)C6=CC=CS6

Isomeric SMILES

C1CC2C(N(N=C2C(=CC3=CC=CS3)C1)C(=O)CSC4=NC5=CC=CC=C5N4)C6=CC=CS6

InChI

InChI=1S/C25H22N4OS3/c30-22(15-33-25-26-19-9-1-2-10-20(19)27-25)29-24(21-11-5-13-32-21)18-8-3-6-16(23(18)28-29)14-17-7-4-12-31-17/h1-2,4-5,7,9-14,18,24H,3,6,8,15H2,(H,26,27)