2-[5-(3,5-dimethylphenyl)sulfanyl-1,2-dimethyl-imidazol-4-yl]propanenitrile

Systemtic Name: 2-[5-(3,5-dimethylphenyl)sulfanyl-1,2-dimethyl-imidazol-4-yl]propanenitrile Openeye Name: 2-[5-(3,5-dimethylphenyl)sulfanyl-1,2-dimethyl-imidazol-4-yl]propanenitrile CAS Name: 2-[5-[(3,5-dimethylphenyl)thio]-1,2-dimethyl-4-imidazolyl]propanenitrile IUPAC Name: 2-[5-(3,5-dimethylphenyl)sulfanyl-1,2-dimethylimidazol-4-yl]propanenitrile Traditional Name: 2-[5-[(3,5-dimethylphenyl)thio]-1,2-dimethyl-imidazol-4-yl]propionitrile Formula: C16H19N3S MolecularWeight: 285.40716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)SC2=C(N=C(N2C)C)C(C)C#N)C

Isomeric SMILES

CC1=CC(=CC(=C1)SC2=C(N=C(N2C)C)C(C)C#N)C

InChI

InChI=1S/C16H19N3S/c1-10-6-11(2)8-14(7-10)20-16-15(12(3)9-17)18-13(4)19(16)5/h6-8,12H,1-5H3