Vitas-M small molecule compound

methyl 4-[4-(ethoxycarbonyl)phenyl]-7-fluoro-4H-1,4-benzothiazine-2-carboxylate 1,1-dioxide

Catalog ID
STL096076
SMILES CCOC(=O)c1ccc(cc1)N1C=C(C(=O)OC)S(=O)(=O)c2c1ccc(c2)F

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C19H16FNO6S MW 405.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16FNO6S/c1-3-27-18(22)12-4-7-14(8-5-12)21-11-17(19(23)26-2)28(24,25)16-10-13(20)6-9-15(16)21/h4-11H,3H2,1-2H3
InChIKey
OJZLZZHEUMJYCN-UHFFFAOYSA-N
Synonyms
1291858-51-9
1291858519
CCOC(=O)C1=CC=C(C=C1)N2C=C(S(=O)(=O)C3=C2C=CC(=C3)F)C(=O)OC
InChI=1SC19H16FNO6Sc132718(22)124714(8512)211117(19(23)262)28(2425)161013(20)6915(16)21h411H3H212H3
methyl4(4(ethoxycarbonyl)phenyl)7fluoro4H14benzothiazine2carboxylate11dioxide
METHYL4(4(ETHOXYCARBONYL)PHENYL)7FLUORO4HBENZO(B)(14)THIAZINE2CARBOXYLATE11DIOXIDE
methyl4(4ethoxycarbonylphenyl)7fluoro11dioxo1$l^(6)4benzothiazine2carboxylate
MFCD18788353
ZINC000064979242
ZINC64979242

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Available files

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