3-[(4Z)-1-(3,5-dimethylphenyl)-4-[(4-methoxyphenyl)methylidene]-5-oxidanylidene-imidazol-2-yl]sulfanylpropanenitrile

Systemtic Name: 3-[(4Z)-1-(3,5-dimethylphenyl)-4-[(4-methoxyphenyl)methylidene]-5-oxidanylidene-imidazol-2-yl]sulfanylpropanenitrile Openeye Name: 3-[(4Z)-1-(3,5-dimethylphenyl)-4-[(4-methoxyphenyl)methylene]-5-oxo-imidazol-2-yl]sulfanylpropanenitrile CAS Name: 3-[[(4Z)-1-(3,5-dimethylphenyl)-4-[(4-methoxyphenyl)methylidene]-5-oxo-2-imidazolyl]thio]propanenitrile IUPAC Name: 3-[(4Z)-1-(3,5-dimethylphenyl)-4-[(4-methoxyphenyl)methylidene]-5-oxoimidazol-2-yl]sulfanylpropanenitrile Traditional Name: 3-[[(4Z)-1-(3,5-dimethylphenyl)-5-keto-4-p-anisylidene-2-imidazolin-2-yl]thio]propionitrile Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C(=O)C(=CC3=CC=C(C=C3)OC)N=C2SCCC#N)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C(=O)/C(=C/C3=CC=C(C=C3)OC)/N=C2SCCC#N)C

InChI

InChI=1S/C22H21N3O2S/c1-15-11-16(2)13-18(12-15)25-21(26)20(24-22(25)28-10-4-9-23)14-17-5-7-19(27-3)8-6-17/h5-8,11-14H,4,10H2,1-3H3/b20-14-