5-(cyclobutylcarbamoylamino)-3-[(2-fluoranyl-4-methyl-phenyl)methoxy]-1,2-thiazole-4-carboxylic acid

Systemtic Name: 5-(cyclobutylcarbamoylamino)-3-[(2-fluoranyl-4-methyl-phenyl)methoxy]-1,2-thiazole-4-carboxylic acid Openeye Name: 5-(cyclobutylcarbamoylamino)-3-[(2-fluoro-4-methyl-phenyl)methoxy]isothiazole-4-carboxylic acid CAS Name: 5-[[(cyclobutylamino)-oxomethyl]amino]-3-[(2-fluoro-4-methylphenyl)methoxy]-4-isothiazolecarboxylic acid IUPAC Name: 5-(cyclobutylcarbamoylamino)-3-[(2-fluoro-4-methylphenyl)methoxy]-1,2-thiazole-4-carboxylic acid Traditional Name: 5-(cyclobutylcarbamoylamino)-3-(2-fluoro-4-methyl-benzyl)oxy-isothiazole-4-carboxylic acid Formula: C17H18FN3O4S MolecularWeight: 379.405923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)COC2=NSC(=C2C(=O)O)NC(=O)NC3CCC3)F

Isomeric SMILES

CC1=CC(=C(C=C1)COC2=NSC(=C2C(=O)O)NC(=O)NC3CCC3)F

InChI

InChI=1S/C17H18FN3O4S/c1-9-5-6-10(12(18)7-9)8-25-14-13(16(22)23)15(26-21-14)20-17(24)19-11-3-2-4-11/h5-7,11H,2-4,8H2,1H3,(H,22,23)(H2,19,20,24)