7-[3-(5-azanyl-1,3-thiazol-4-yl)pyrrolidin-1-yl]-1-cyclopropyl-6-fluoranyl-5-methyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[3-(5-azanyl-1,3-thiazol-4-yl)pyrrolidin-1-yl]-1-cyclopropyl-6-fluoranyl-5-methyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[3-(5-aminothiazol-4-yl)pyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-5-methyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[3-(5-amino-4-thiazolyl)-1-pyrrolidinyl]-1-cyclopropyl-6-fluoro-5-methyl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[3-(5-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-5-methyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[3-(5-aminothiazol-4-yl)pyrrolidino]-1-cyclopropyl-6-fluoro-4-keto-5-methyl-quinoline-3-carboxylic acid Formula: C21H21FN4O3S MolecularWeight: 428.479843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1F)N3CCC(C3)C4=C(SC=N4)N)N(C=C(C2=O)C(=O)O)C5CC5

Isomeric SMILES

CC1=C2C(=CC(=C1F)N3CCC(C3)C4=C(SC=N4)N)N(C=C(C2=O)C(=O)O)C5CC5

InChI

InChI=1S/C21H21FN4O3S/c1-10-16-14(26(12-2-3-12)8-13(19(16)27)21(28)29)6-15(17(10)22)25-5-4-11(7-25)18-20(23)30-9-24-18/h6,8-9,11-12H,2-5,7,23H2,1H3,(H,28,29)