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

Systemtic Name: [2-[(4-fluoranylphenoxy)methyl]-1,3-thiazol-4-yl]methyl 2-methylquinoline-4-carboxylate Openeye Name: [2-[(4-fluorophenoxy)methyl]thiazol-4-yl]methyl 2-methylquinoline-4-carboxylate CAS Name: 2-methyl-4-quinolinecarboxylic acid [2-[(4-fluorophenoxy)methyl]-4-thiazolyl]methyl ester IUPAC Name: [2-[(4-fluorophenoxy)methyl]-1,3-thiazol-4-yl]methyl 2-methylquinoline-4-carboxylate Traditional Name: 2-methylcinchoninic acid [2-[(4-fluorophenoxy)methyl]thiazol-4-yl]methyl ester Formula: C22H17FN2O3S MolecularWeight: 408.445383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)C(=O)OCC3=CSC(=N3)COC4=CC=C(C=C4)F

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)C(=O)OCC3=CSC(=N3)COC4=CC=C(C=C4)F

InChI

InChI=1S/C22H17FN2O3S/c1-14-10-19(18-4-2-3-5-20(18)24-14)22(26)28-11-16-13-29-21(25-16)12-27-17-8-6-15(23)7-9-17/h2-10,13H,11-12H2,1H3