6-(3-azanylpyrrolidin-1-yl)-7-fluoranyl-8-methyl-1-oxidanylidene-4-(1,3-thiazol-5-yl)-4H-naphthalene-2-carboxylic acid

Systemtic Name: 6-(3-azanylpyrrolidin-1-yl)-7-fluoranyl-8-methyl-1-oxidanylidene-4-(1,3-thiazol-5-yl)-4H-naphthalene-2-carboxylic acid Openeye Name: 6-(3-aminopyrrolidin-1-yl)-7-fluoro-8-methyl-1-oxo-4-thiazol-5-yl-4H-naphthalene-2-carboxylic acid CAS Name: 6-(3-amino-1-pyrrolidinyl)-7-fluoro-8-methyl-1-oxo-4-(5-thiazolyl)-4H-naphthalene-2-carboxylic acid IUPAC Name: 6-(3-aminopyrrolidin-1-yl)-7-fluoro-8-methyl-1-oxo-4-(1,3-thiazol-5-yl)-4H-naphthalene-2-carboxylic acid Traditional Name: 6-(3-aminopyrrolidino)-7-fluoro-1-keto-8-methyl-4-thiazol-5-yl-4H-naphthalene-2-carboxylic acid Formula: C19H18FN3O3S MolecularWeight: 387.427923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1F)N3CCC(C3)N)C(C=C(C2=O)C(=O)O)C4=CN=CS4

Isomeric SMILES

CC1=C2C(=CC(=C1F)N3CCC(C3)N)C(C=C(C2=O)C(=O)O)C4=CN=CS4

InChI

InChI=1S/C19H18FN3O3S/c1-9-16-12(5-14(17(9)20)23-3-2-10(21)7-23)11(15-6-22-8-27-15)4-13(18(16)24)19(25)26/h4-6,8,10-11H,2-3,7,21H2,1H3,(H,25,26)