ethyl 4-fluoranyl-3-[[(E)-3-(2-methyl-1,3-thiazol-4-yl)prop-2-enoyl]oxymethyl]-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 4-fluoranyl-3-[[(E)-3-(2-methyl-1,3-thiazol-4-yl)prop-2-enoyl]oxymethyl]-1-benzothiophene-2-carboxylate Openeye Name: ethyl 4-fluoro-3-[[(E)-3-(2-methylthiazol-4-yl)prop-2-enoyl]oxymethyl]benzothiophene-2-carboxylate CAS Name: 4-fluoro-3-[[(E)-3-(2-methyl-4-thiazolyl)-1-oxoprop-2-enoxy]methyl]-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-fluoro-3-[[(E)-3-(2-methyl-1,3-thiazol-4-yl)prop-2-enoyl]oxymethyl]-1-benzothiophene-2-carboxylate Traditional Name: 4-fluoro-3-[[(E)-3-(2-methylthiazol-4-yl)acryloyl]oxymethyl]benzothiophene-2-carboxylic acid ethyl ester Formula: C19H16FNO4S2 MolecularWeight: 405.463043

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)COC(=O)C=CC3=CSC(=N3)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)COC(=O)/C=C/C3=CSC(=N3)C

InChI

InChI=1S/C19H16FNO4S2/c1-3-24-19(23)18-13(17-14(20)5-4-6-15(17)27-18)9-25-16(22)8-7-12-10-26-11(2)21-12/h4-8,10H,3,9H2,1-2H3/b8-7+