3-methyl-1-phenacylsulfanyl-pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 3-methyl-1-phenacylsulfanyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 3-methyl-1-phenacylsulfanyl-pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 3-methyl-1-(phenacylthio)-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 3-methyl-1-phenacylsulfanylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 3-methyl-1-(phenacylthio)pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C21H15N3OS MolecularWeight: 357.4283

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC(=O)C4=CC=CC=C4)C#N

Isomeric SMILES

CC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC(=O)C4=CC=CC=C4)C#N

InChI

InChI=1S/C21H15N3OS/c1-14-11-20(26-13-19(25)15-7-3-2-4-8-15)24-18-10-6-5-9-17(18)23-21(24)16(14)12-22/h2-11H,13H2,1H3