2-[(6-methyl-1H-benzimidazol-2-yl)methylsulfanyl]-6-pyridin-4-yl-pyridine-3-carbonitrile

Systemtic Name: 2-[(6-methyl-1H-benzimidazol-2-yl)methylsulfanyl]-6-pyridin-4-yl-pyridine-3-carbonitrile Openeye Name: 2-[(6-methyl-1H-benzimidazol-2-yl)methylsulfanyl]-6-(4-pyridyl)pyridine-3-carbonitrile CAS Name: 2-[(6-methyl-1H-benzimidazol-2-yl)methylthio]-6-pyridin-4-yl-3-pyridinecarbonitrile IUPAC Name: 2-[(6-methyl-1H-benzimidazol-2-yl)methylsulfanyl]-6-pyridin-4-ylpyridine-3-carbonitrile Traditional Name: 2-[(6-methyl-1H-benzimidazol-2-yl)methylthio]-6-(4-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=CC=NC=C4)C#N

Isomeric SMILES

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

InChI

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