4-[4-[2-(2,5-dimethylthiophen-3-yl)-2-oxidanylidene-ethoxy]phenyl]benzenecarbonitrile

Systemtic Name: 4-[4-[2-(2,5-dimethylthiophen-3-yl)-2-oxidanylidene-ethoxy]phenyl]benzenecarbonitrile Openeye Name: 4-[4-[2-(2,5-dimethyl-3-thienyl)-2-oxo-ethoxy]phenyl]benzonitrile CAS Name: 4-[4-[2-(2,5-dimethyl-3-thiophenyl)-2-oxoethoxy]phenyl]benzonitrile IUPAC Name: 4-[4-[2-(2,5-dimethylthiophen-3-yl)-2-oxoethoxy]phenyl]benzonitrile Traditional Name: 4-[4-[2-(2,5-dimethyl-3-thienyl)-2-keto-ethoxy]phenyl]benzonitrile Formula: C21H17NO2S MolecularWeight: 347.43018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)COC2=CC=C(C=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)COC2=CC=C(C=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H17NO2S/c1-14-11-20(15(2)25-14)21(23)13-24-19-9-7-18(8-10-19)17-5-3-16(12-22)4-6-17/h3-11H,13H2,1-2H3