3-ethyl-1-[2-(4-ethylphenyl)-2-oxidanylidene-ethyl]sulfanyl-pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 3-ethyl-1-[2-(4-ethylphenyl)-2-oxidanylidene-ethyl]sulfanyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 3-ethyl-1-[2-(4-ethylphenyl)-2-oxo-ethyl]sulfanyl-pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 3-ethyl-1-[[2-(4-ethylphenyl)-2-oxoethyl]thio]-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 3-ethyl-1-[2-(4-ethylphenyl)-2-oxoethyl]sulfanylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 3-ethyl-1-[[2-(4-ethylphenyl)-2-keto-ethyl]thio]pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C24H21N3OS MolecularWeight: 399.50804

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)CSC2=CC(=C(C3=NC4=CC=CC=C4N23)C#N)CC

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)CSC2=CC(=C(C3=NC4=CC=CC=C4N23)C#N)CC

InChI

InChI=1S/C24H21N3OS/c1-3-16-9-11-18(12-10-16)22(28)15-29-23-13-17(4-2)19(14-25)24-26-20-7-5-6-8-21(20)27(23)24/h5-13H,3-4,15H2,1-2H3