[2-[ethanoyl(phenyl)amino]-1,3-thiazol-4-yl]methyl 5-fluoranyl-1-benzothiophene-2-carboxylate

Systemtic Name: [2-[ethanoyl(phenyl)amino]-1,3-thiazol-4-yl]methyl 5-fluoranyl-1-benzothiophene-2-carboxylate Openeye Name: [2-(N-acetylanilino)thiazol-4-yl]methyl 5-fluorobenzothiophene-2-carboxylate CAS Name: 5-fluoro-1-benzothiophene-2-carboxylic acid [2-(N-acetylanilino)-4-thiazolyl]methyl ester IUPAC Name: [2-(N-acetylanilino)-1,3-thiazol-4-yl]methyl 5-fluoro-1-benzothiophene-2-carboxylate Traditional Name: 5-fluorobenzothiophene-2-carboxylic acid [2-(N-acetylanilino)thiazol-4-yl]methyl ester Formula: C21H15FN2O3S2 MolecularWeight: 426.483803

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C1=CC=CC=C1)C2=NC(=CS2)COC(=O)C3=CC4=C(S3)C=CC(=C4)F

Isomeric SMILES

CC(=O)N(C1=CC=CC=C1)C2=NC(=CS2)COC(=O)C3=CC4=C(S3)C=CC(=C4)F

InChI

InChI=1S/C21H15FN2O3S2/c1-13(25)24(17-5-3-2-4-6-17)21-23-16(12-28-21)11-27-20(26)19-10-14-9-15(22)7-8-18(14)29-19/h2-10,12H,11H2,1H3