(E)-2-[5-(4-fluorophenyl)carbonylthiophen-2-yl]-3-(4-methoxyphenyl)prop-2-enenitrile

Systemtic Name: (E)-2-[5-(4-fluorophenyl)carbonylthiophen-2-yl]-3-(4-methoxyphenyl)prop-2-enenitrile Openeye Name: (E)-2-[5-(4-fluorobenzoyl)-2-thienyl]-3-(4-methoxyphenyl)prop-2-enenitrile CAS Name: (E)-2-[5-[(4-fluorophenyl)-oxomethyl]-2-thiophenyl]-3-(4-methoxyphenyl)-2-propenenitrile IUPAC Name: (E)-2-[5-(4-fluorobenzoyl)thiophen-2-yl]-3-(4-methoxyphenyl)prop-2-enenitrile Traditional Name: (E)-2-[5-(4-fluorobenzoyl)-2-thienyl]-3-(4-methoxyphenyl)acrylonitrile Formula: C21H14FNO2S MolecularWeight: 363.404763

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC1=CC=C(C=C1)/C=C(\C#N)/C2=CC=C(S2)C(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H14FNO2S/c1-25-18-8-2-14(3-9-18)12-16(13-23)19-10-11-20(26-19)21(24)15-4-6-17(22)7-5-15/h2-12H,1H3/b16-12+