7-(3-azanylpyrrolidin-1-yl)-1-cyclopropyl-6-fluoranyl-5-methylsulfanyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-(3-azanylpyrrolidin-1-yl)-1-cyclopropyl-6-fluoranyl-5-methylsulfanyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(3-aminopyrrolidin-1-yl)-1-cyclopropyl-6-fluoro-5-methylsulfanyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(3-amino-1-pyrrolidinyl)-1-cyclopropyl-6-fluoro-5-(methylthio)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(3-aminopyrrolidin-1-yl)-1-cyclopropyl-6-fluoro-5-methylsulfanyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(3-aminopyrrolidino)-1-cyclopropyl-6-fluoro-4-keto-5-(methylthio)quinoline-3-carboxylic acid Formula: C18H20FN3O3S MolecularWeight: 377.433103

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C2C(=CC(=C1F)N3CCC(C3)N)N(C=C(C2=O)C(=O)O)C4CC4

Isomeric SMILES

CSC1=C2C(=CC(=C1F)N3CCC(C3)N)N(C=C(C2=O)C(=O)O)C4CC4

InChI

InChI=1S/C18H20FN3O3S/c1-26-17-14-12(6-13(15(17)19)21-5-4-9(20)7-21)22(10-2-3-10)8-11(16(14)23)18(24)25/h6,8-10H,2-5,7,20H2,1H3,(H,24,25)