(7-methyl-2-oxidanylidene-chromen-4-yl)methyl 1-(4-fluorophenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxylate

Systemtic Name: (7-methyl-2-oxidanylidene-chromen-4-yl)methyl 1-(4-fluorophenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxylate Openeye Name: (7-methyl-2-oxo-chromen-4-yl)methyl 1-(4-fluorophenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxylate CAS Name: 1-(4-fluorophenyl)-3-methyl-5-thieno[2,3-c]pyrazolecarboxylic acid (7-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methyl-2-oxochromen-4-yl)methyl 1-(4-fluorophenyl)-3-methylthieno[2,3-c]pyrazole-5-carboxylate Traditional Name: 1-(4-fluorophenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxylic acid (2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C24H17FN2O4S MolecularWeight: 448.466183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC4=C(S3)N(N=C4C)C5=CC=C(C=C5)F

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC4=C(S3)N(N=C4C)C5=CC=C(C=C5)F

InChI

InChI=1S/C24H17FN2O4S/c1-13-3-8-18-15(10-22(28)31-20(18)9-13)12-30-24(29)21-11-19-14(2)26-27(23(19)32-21)17-6-4-16(25)5-7-17/h3-11H,12H2,1-2H3