1-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 1-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 1-(3,3-dimethyl-2-oxo-butyl)sulfanyl-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 1-[(3,3-dimethyl-2-oxobutyl)thio]-3-methyl-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 1-(3,3-dimethyl-2-oxobutyl)sulfanyl-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 1-[(2-keto-3,3-dimethyl-butyl)thio]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C19H19N3OS MolecularWeight: 337.43866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC(=O)C(C)(C)C)C#N

Isomeric SMILES

CC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC(=O)C(C)(C)C)C#N

InChI

InChI=1S/C19H19N3OS/c1-12-9-17(24-11-16(23)19(2,3)4)22-15-8-6-5-7-14(15)21-18(22)13(12)10-20/h5-9H,11H2,1-4H3