2-(4-methoxyphenyl)-2-(5-oxidanylidene-2,3-diphenyl-thiophen-2-yl)ethanenitrile

Systemtic Name: 2-(4-methoxyphenyl)-2-(5-oxidanylidene-2,3-diphenyl-thiophen-2-yl)ethanenitrile Openeye Name: 2-(4-methoxyphenyl)-2-(5-oxo-2,3-diphenyl-2-thienyl)acetonitrile CAS Name: 2-(4-methoxyphenyl)-2-(5-oxo-2,3-diphenyl-2-thiophenyl)acetonitrile IUPAC Name: 2-(4-methoxyphenyl)-2-(5-oxo-2,3-diphenylthiophen-2-yl)acetonitrile Traditional Name: 2-(5-keto-2,3-diphenyl-2-thienyl)-2-(4-methoxyphenyl)acetonitrile Formula: C25H19NO2S MolecularWeight: 397.48886

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C#N)C2(C(=CC(=O)S2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C(C#N)C2(C(=CC(=O)S2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H19NO2S/c1-28-21-14-12-19(13-15-21)23(17-26)25(20-10-6-3-7-11-20)22(16-24(27)29-25)18-8-4-2-5-9-18/h2-16,23H,1H3