2-[(4E)-1-(3-methoxyphenyl)-5-oxidanylidene-4-[(4-propan-2-ylphenyl)methylidene]imidazol-2-yl]sulfanylethanenitrile

Systemtic Name: 2-[(4E)-1-(3-methoxyphenyl)-5-oxidanylidene-4-[(4-propan-2-ylphenyl)methylidene]imidazol-2-yl]sulfanylethanenitrile Openeye Name: 2-[(4E)-4-[(4-isopropylphenyl)methylene]-1-(3-methoxyphenyl)-5-oxo-imidazol-2-yl]sulfanylacetonitrile CAS Name: 2-[[(4E)-1-(3-methoxyphenyl)-5-oxo-4-[(4-propan-2-ylphenyl)methylidene]-2-imidazolyl]thio]acetonitrile IUPAC Name: 2-[(4E)-1-(3-methoxyphenyl)-5-oxo-4-[(4-propan-2-ylphenyl)methylidene]imidazol-2-yl]sulfanylacetonitrile Traditional Name: 2-[[(4E)-4-(4-isopropylbenzylidene)-5-keto-1-(3-methoxyphenyl)-2-imidazolin-2-yl]thio]acetonitrile Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C=C2C(=O)N(C(=N2)SCC#N)C3=CC(=CC=C3)OC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)/C=C/2\C(=O)N(C(=N2)SCC#N)C3=CC(=CC=C3)OC

InChI

InChI=1S/C22H21N3O2S/c1-15(2)17-9-7-16(8-10-17)13-20-21(26)25(22(24-20)28-12-11-23)18-5-4-6-19(14-18)27-3/h4-10,13-15H,12H2,1-3H3/b20-13+