1-[(3R)-4-azanylidene-3-cyano-2-oxidanylidene-pentyl]sulfanyl-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 1-[(3R)-4-azanylidene-3-cyano-2-oxidanylidene-pentyl]sulfanyl-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 1-[(3R)-3-cyano-4-imino-2-oxo-pentyl]sulfanyl-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 1-[[(3R)-3-cyano-4-imino-2-oxopentyl]thio]-3-methyl-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 1-[(3R)-3-cyano-4-imino-2-oxopentyl]sulfanyl-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 1-[[(3R)-3-cyano-4-imino-2-keto-pentyl]thio]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C19H15N5OS MolecularWeight: 361.4203

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC(=O)[C@@H](C#N)C(=N)C)C#N

InChI

InChI=1S/C19H15N5OS/c1-11-7-18(26-10-17(25)14(9-21)12(2)22)24-16-6-4-3-5-15(16)23-19(24)13(11)8-20/h3-7,14,22H,10H2,1-2H3/t14-/m0/s1