1-[2-(2,3-dihydro-1H-inden-5-yl)-2-oxidanylidene-ethyl]sulfanyl-3-ethyl-pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 1-[2-(2,3-dihydro-1H-inden-5-yl)-2-oxidanylidene-ethyl]sulfanyl-3-ethyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 3-ethyl-1-(2-indan-5-yl-2-oxo-ethyl)sulfanyl-pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 1-[[2-(2,3-dihydro-1H-inden-5-yl)-2-oxoethyl]thio]-3-ethyl-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 1-[2-(2,3-dihydro-1H-inden-5-yl)-2-oxoethyl]sulfanyl-3-ethylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 3-ethyl-1-[(2-indan-5-yl-2-keto-ethyl)thio]pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C25H21N3OS MolecularWeight: 411.51874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC(=O)C4=CC5=C(CCC5)C=C4)C#N

Isomeric SMILES

CCC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC(=O)C4=CC5=C(CCC5)C=C4)C#N

InChI

InChI=1S/C25H21N3OS/c1-2-16-13-24(28-22-9-4-3-8-21(22)27-25(28)20(16)14-26)30-15-23(29)19-11-10-17-6-5-7-18(17)12-19/h3-4,8-13H,2,5-7,15H2,1H3