methyl 2-[3-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]phenyl]-5-oxidanylidene-pyrazolidine-1-carboxylate

Systemtic Name: methyl 2-[3-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]phenyl]-5-oxidanylidene-pyrazolidine-1-carboxylate Openeye Name: methyl 2-[3-[4-(4-fluorophenyl)thiazol-2-yl]phenyl]-5-oxo-pyrazolidine-1-carboxylate CAS Name: 2-[3-[4-(4-fluorophenyl)-2-thiazolyl]phenyl]-5-oxo-1-pyrazolidinecarboxylic acid methyl ester IUPAC Name: methyl 2-[3-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]phenyl]-5-oxopyrazolidine-1-carboxylate Traditional Name: 2-[3-[4-(4-fluorophenyl)thiazol-2-yl]phenyl]-5-keto-pyrazolidine-1-carboxylic acid methyl ester Formula: C20H16FN3O3S MolecularWeight: 397.422743

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1C(=O)CCN1C2=CC=CC(=C2)C3=NC(=CS3)C4=CC=C(C=C4)F

Isomeric SMILES

COC(=O)N1C(=O)CCN1C2=CC=CC(=C2)C3=NC(=CS3)C4=CC=C(C=C4)F

InChI

InChI=1S/C20H16FN3O3S/c1-27-20(26)24-18(25)9-10-23(24)16-4-2-3-14(11-16)19-22-17(12-28-19)13-5-7-15(21)8-6-13/h2-8,11-12H,9-10H2,1H3