3-[2-[(3-methoxyphenyl)methylsulfanyl]benzimidazol-1-yl]propanenitrile

Systemtic Name: 3-[2-[(3-methoxyphenyl)methylsulfanyl]benzimidazol-1-yl]propanenitrile Openeye Name: 3-[2-[(3-methoxyphenyl)methylsulfanyl]benzimidazol-1-yl]propanenitrile CAS Name: 3-[2-[(3-methoxyphenyl)methylthio]-1-benzimidazolyl]propanenitrile IUPAC Name: 3-[2-[(3-methoxyphenyl)methylsulfanyl]benzimidazol-1-yl]propanenitrile Traditional Name: 3-[2-(m-anisylthio)benzimidazol-1-yl]propionitrile Formula: C18H17N3OS MolecularWeight: 323.41208

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CSC2=NC3=CC=CC=C3N2CCC#N

Isomeric SMILES

COC1=CC=CC(=C1)CSC2=NC3=CC=CC=C3N2CCC#N

InChI

InChI=1S/C18H17N3OS/c1-22-15-7-4-6-14(12-15)13-23-18-20-16-8-2-3-9-17(16)21(18)11-5-10-19/h2-4,6-9,12H,5,11,13H2,1H3