[2-[(4-fluoranylphenoxy)methyl]-1,3-thiazol-4-yl]methyl 3-methyl-1-benzothiophene-2-carboxylate

Systemtic Name: [2-[(4-fluoranylphenoxy)methyl]-1,3-thiazol-4-yl]methyl 3-methyl-1-benzothiophene-2-carboxylate Openeye Name: [2-[(4-fluorophenoxy)methyl]thiazol-4-yl]methyl 3-methylbenzothiophene-2-carboxylate CAS Name: 3-methyl-1-benzothiophene-2-carboxylic acid [2-[(4-fluorophenoxy)methyl]-4-thiazolyl]methyl ester IUPAC Name: [2-[(4-fluorophenoxy)methyl]-1,3-thiazol-4-yl]methyl 3-methyl-1-benzothiophene-2-carboxylate Traditional Name: 3-methylbenzothiophene-2-carboxylic acid [2-[(4-fluorophenoxy)methyl]thiazol-4-yl]methyl ester Formula: C21H16FNO3S2 MolecularWeight: 413.485043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC=C12)C(=O)OCC3=CSC(=N3)COC4=CC=C(C=C4)F

Isomeric SMILES

CC1=C(SC2=CC=CC=C12)C(=O)OCC3=CSC(=N3)COC4=CC=C(C=C4)F

InChI

InChI=1S/C21H16FNO3S2/c1-13-17-4-2-3-5-18(17)28-20(13)21(24)26-10-15-12-27-19(23-15)11-25-16-8-6-14(22)7-9-16/h2-9,12H,10-11H2,1H3