ethyl 4-[[3-(4-fluorophenyl)-2-thiophen-3-yl-prop-2-enoyl]amino]benzoate

Systemtic Name: ethyl 4-[[3-(4-fluorophenyl)-2-thiophen-3-yl-prop-2-enoyl]amino]benzoate Openeye Name: ethyl 4-[[3-(4-fluorophenyl)-2-(3-thienyl)prop-2-enoyl]amino]benzoate CAS Name: 4-[[3-(4-fluorophenyl)-1-oxo-2-(3-thiophenyl)prop-2-enyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[3-(4-fluorophenyl)-2-thiophen-3-ylprop-2-enoyl]amino]benzoate Traditional Name: 4-[[3-(4-fluorophenyl)-2-(3-thienyl)acryloyl]amino]benzoic acid ethyl ester Formula: C22H18FNO3S MolecularWeight: 395.446623

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(=CC2=CC=C(C=C2)F)C3=CSC=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(=CC2=CC=C(C=C2)F)C3=CSC=C3

InChI

InChI=1S/C22H18FNO3S/c1-2-27-22(26)16-5-9-19(10-6-16)24-21(25)20(17-11-12-28-14-17)13-15-3-7-18(23)8-4-15/h3-14H,2H2,1H3,(H,24,25)