2-[(6-methyl-1H-benzimidazol-2-yl)methylsulfanyl]-6-pyridin-3-yl-pyridine-3-carbonitrile

Systemtic Name: 2-[(6-methyl-1H-benzimidazol-2-yl)methylsulfanyl]-6-pyridin-3-yl-pyridine-3-carbonitrile Openeye Name: 2-[(6-methyl-1H-benzimidazol-2-yl)methylsulfanyl]-6-(3-pyridyl)pyridine-3-carbonitrile CAS Name: 2-[(6-methyl-1H-benzimidazol-2-yl)methylthio]-6-(3-pyridinyl)-3-pyridinecarbonitrile IUPAC Name: 2-[(6-methyl-1H-benzimidazol-2-yl)methylsulfanyl]-6-pyridin-3-ylpyridine-3-carbonitrile Traditional Name: 2-[(6-methyl-1H-benzimidazol-2-yl)methylthio]-6-(3-pyridyl)nicotinonitrile Formula: C20H15N5S MolecularWeight: 357.4316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)CSC3=C(C=CC(=N3)C4=CN=CC=C4)C#N

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)CSC3=C(C=CC(=N3)C4=CN=CC=C4)C#N

InChI

InChI=1S/C20H15N5S/c1-13-4-6-17-18(9-13)24-19(23-17)12-26-20-14(10-21)5-7-16(25-20)15-3-2-8-22-11-15/h2-9,11H,12H2,1H3,(H,23,24)