3-[2-[(2-oxidanylidene-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methylsulfanyl]benzimidazol-1-yl]propanenitrile

Systemtic Name: 3-[2-[(2-oxidanylidene-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methylsulfanyl]benzimidazol-1-yl]propanenitrile Openeye Name: 3-[2-[(2-oxo-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methylsulfanyl]benzimidazol-1-yl]propanenitrile CAS Name: 3-[2-[(2-oxo-7,8-dihydro-6H-cyclopenta[g][1]benzopyran-4-yl)methylthio]-1-benzimidazolyl]propanenitrile IUPAC Name: 3-[2-[(2-oxo-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methylsulfanyl]benzimidazol-1-yl]propanenitrile Traditional Name: 3-[2-[(2-keto-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methylthio]benzimidazol-1-yl]propionitrile Formula: C23H19N3O2S MolecularWeight: 401.48086

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C3C(=C2)C(=CC(=O)O3)CSC4=NC5=CC=CC=C5N4CCC#N

Isomeric SMILES

C1CC2=C(C1)C=C3C(=C2)C(=CC(=O)O3)CSC4=NC5=CC=CC=C5N4CCC#N

InChI

InChI=1S/C23H19N3O2S/c24-9-4-10-26-20-8-2-1-7-19(20)25-23(26)29-14-17-13-22(27)28-21-12-16-6-3-5-15(16)11-18(17)21/h1-2,7-8,11-13H,3-6,10,14H2