[2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl 2,3-dimethylquinoxaline-6-carboxylate

Systemtic Name: [2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl 2,3-dimethylquinoxaline-6-carboxylate Openeye Name: [2-(4-fluorophenyl)thiazol-4-yl]methyl 2,3-dimethylquinoxaline-6-carboxylate CAS Name: 2,3-dimethyl-6-quinoxalinecarboxylic acid [2-(4-fluorophenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl 2,3-dimethylquinoxaline-6-carboxylate Traditional Name: 2,3-dimethylquinoxaline-6-carboxylic acid [2-(4-fluorophenyl)thiazol-4-yl]methyl ester Formula: C21H16FN3O2S MolecularWeight: 393.434043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)C(=O)OCC3=CSC(=N3)C4=CC=C(C=C4)F)N=C1C

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)C(=O)OCC3=CSC(=N3)C4=CC=C(C=C4)F)N=C1C

InChI

InChI=1S/C21H16FN3O2S/c1-12-13(2)24-19-9-15(5-8-18(19)23-12)21(26)27-10-17-11-28-20(25-17)14-3-6-16(22)7-4-14/h3-9,11H,10H2,1-2H3