1-(1,3-benzothiazol-2-ylmethylsulfanyl)-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 1-(1,3-benzothiazol-2-ylmethylsulfanyl)-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 1-(1,3-benzothiazol-2-ylmethylsulfanyl)-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 1-(1,3-benzothiazol-2-ylmethylthio)-3-methyl-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 1-(1,3-benzothiazol-2-ylmethylsulfanyl)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 1-(1,3-benzothiazol-2-ylmethylthio)-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C21H14N4S2 MolecularWeight: 386.49266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC4=NC5=CC=CC=C5S4)C#N

Isomeric SMILES

CC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC4=NC5=CC=CC=C5S4)C#N

InChI

InChI=1S/C21H14N4S2/c1-13-10-20(26-12-19-23-16-7-3-5-9-18(16)27-19)25-17-8-4-2-6-15(17)24-21(25)14(13)11-22/h2-10H,12H2,1H3