ethyl 2-[3-(4-fluorophenyl)prop-2-enoylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[3-(4-fluorophenyl)prop-2-enoylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[3-(4-fluorophenyl)prop-2-enoylamino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[3-(4-fluorophenyl)-1-oxoprop-2-enyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[3-(4-fluorophenyl)prop-2-enoylamino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[[3-(4-fluorophenyl)acryloyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C18H18FNO3S MolecularWeight: 347.403823

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C=CC2=CC=C(C=C2)F

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C=CC2=CC=C(C=C2)F

InChI

InChI=1S/C18H18FNO3S/c1-4-23-18(22)16-11(2)12(3)24-17(16)20-15(21)10-7-13-5-8-14(19)9-6-13/h5-10H,4H2,1-3H3,(H,20,21)