2-ethyl-3-methyl-1-prop-2-enylsulfanyl-pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 2-ethyl-3-methyl-1-prop-2-enylsulfanyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 1-allylsulfanyl-2-ethyl-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 2-ethyl-3-methyl-1-(prop-2-enylthio)-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 2-ethyl-3-methyl-1-prop-2-enylsulfanylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 1-(allylthio)-2-ethyl-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C18H17N3S MolecularWeight: 307.41268

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N2C3=CC=CC=C3N=C2C(=C1C)C#N)SCC=C

Isomeric SMILES

CCC1=C(N2C3=CC=CC=C3N=C2C(=C1C)C#N)SCC=C

InChI

InChI=1S/C18H17N3S/c1-4-10-22-18-13(5-2)12(3)14(11-19)17-20-15-8-6-7-9-16(15)21(17)18/h4,6-9H,1,5,10H2,2-3H3