7-fluoranyl-1-methyl-5-oxidanylidene-8-piperazin-1-yl-[1,3]thiazolo[3,2-a]quinoline-4-carboxylic acid hydrate

Systemtic Name: 7-fluoranyl-1-methyl-5-oxidanylidene-8-piperazin-1-yl-[1,3]thiazolo[3,2-a]quinoline-4-carboxylic acid hydrate Openeye Name: 7-fluoro-1-methyl-5-oxo-8-piperazin-1-yl-thiazolo[3,2-a]quinoline-4-carboxylic acid hydrate CAS Name: 7-fluoro-1-methyl-5-oxo-8-(1-piperazinyl)-4-thiazolo[3,2-a]quinolinecarboxylic acid hydrate IUPAC Name: 7-fluoro-1-methyl-5-oxo-8-piperazin-1-yl-[1,3]thiazolo[3,2-a]quinoline-4-carboxylic acid hydrate Traditional Name: 7-fluoro-5-keto-1-methyl-8-piperazino-thiazolo[3,2-a]quinoline-4-carboxylic acid hydrate Formula: C17H18FN3O4S MolecularWeight: 379.405923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC2=C(C(=O)C3=CC(=C(C=C3N12)N4CCNCC4)F)C(=O)O.O

Isomeric SMILES

CC1=CSC2=C(C(=O)C3=CC(=C(C=C3N12)N4CCNCC4)F)C(=O)O.O

InChI

InChI=1S/C17H16FN3O3S.H2O/c1-9-8-25-16-14(17(23)24)15(22)10-6-11(18)13(7-12(10)21(9)16)20-4-2-19-3-5-20;/h6-8,19H,2-5H2,1H3,(H,23,24);1H2