3-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]-2-methyl-propanenitrile

Systemtic Name: 3-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]-2-methyl-propanenitrile Openeye Name: 3-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]-2-methyl-propanenitrile CAS Name: 3-[(6-methoxy-1H-benzimidazol-2-yl)thio]-2-methylpropanenitrile IUPAC Name: 3-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]-2-methylpropanenitrile Traditional Name: 3-[(6-methoxy-1H-benzimidazol-2-yl)thio]-2-methyl-propionitrile Formula: C12H13N3OS MolecularWeight: 247.31612

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC1=NC2=C(N1)C=C(C=C2)OC)C#N

Isomeric SMILES

CC(CSC1=NC2=C(N1)C=C(C=C2)OC)C#N

InChI

InChI=1S/C12H13N3OS/c1-8(6-13)7-17-12-14-10-4-3-9(16-2)5-11(10)15-12/h3-5,8H,7H2,1-2H3,(H,14,15)