methyl 2-[6-fluoranyl-2-(1-methylpyrazol-3-yl)carbonylimino-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[6-fluoranyl-2-(1-methylpyrazol-3-yl)carbonylimino-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[6-fluoro-2-(1-methylpyrazole-3-carbonyl)imino-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[6-fluoro-2-[(1-methyl-3-pyrazolyl)-oxomethyl]imino-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[6-fluoro-2-(1-methylpyrazole-3-carbonyl)imino-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[6-fluoro-2-(1-methylpyrazole-3-carbonyl)imino-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C15H13FN4O3S MolecularWeight: 348.352123

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=N1)C(=O)N=C2N(C3=C(S2)C=C(C=C3)F)CC(=O)OC

Isomeric SMILES

CN1C=CC(=N1)C(=O)N=C2N(C3=C(S2)C=C(C=C3)F)CC(=O)OC

InChI

InChI=1S/C15H13FN4O3S/c1-19-6-5-10(18-19)14(22)17-15-20(8-13(21)23-2)11-4-3-9(16)7-12(11)24-15/h3-7H,8H2,1-2H3