3-ethyl-1-[(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 3-ethyl-1-[(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 3-ethyl-1-[(7-hydroxy-2-oxo-chromen-4-yl)methylsulfanyl]pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 3-ethyl-1-[(7-hydroxy-2-oxo-1-benzopyran-4-yl)methylthio]-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 3-ethyl-1-[(7-hydroxy-2-oxochromen-4-yl)methylsulfanyl]pyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 3-ethyl-1-[(7-hydroxy-2-keto-chromen-4-yl)methylthio]pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C24H17N3O3S MolecularWeight: 427.47508

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC4=CC(=O)OC5=C4C=CC(=C5)O)C#N

Isomeric SMILES

CCC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC4=CC(=O)OC5=C4C=CC(=C5)O)C#N

InChI

InChI=1S/C24H17N3O3S/c1-2-14-9-22(27-20-6-4-3-5-19(20)26-24(27)18(14)12-25)31-13-15-10-23(29)30-21-11-16(28)7-8-17(15)21/h3-11,28H,2,13H2,1H3