Vitas-M small molecule compound
methyl 2-({[3-oxo-6-(trifluoromethyl)-3,4-dihydro-2H-1,4-benzothiazin-2-yl]acetyl}amino)-5-propylthiophene-3-carboxylate
Catalog ID
STK988584
SMILES CCCc1cc(c(s1)NC(=O)CC1Sc2ccc(cc2NC1=O)C(F)(F)F)C(=O)OC
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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 C20H19F3N2O4S2 MW 472.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19F3N2O4S2/c1-3-4-11-8-12(19(28)29-2)18(30-11)25-16(26)9-15-17(27)24-13-7-10(20(21,22)23)5-6-14(13)31-15/h5-8,15H,3-4,9H2,1-2H3,(H,24,27)(H,25,26)InChIKey
JUNUIHKLUSETRA-UHFFFAOYSA-NSynonyms
1105243-94-41105243944
CCCC1=CC(=C(S1)NC(=O)CC2C(=O)NC3=C(S2)C=CC(=C3)C(F)(F)F)C(=O)OC
InChI=1SC20H19F3N2O4S2c13411812(19(28)292)18(3011)2516(26)91517(27)2413710(20(2122)23)5614(13)3115h5815H349H212H3(H2427)(H2526)
methyl2(((3oxo6(trifluoromethyl)34dihydro2H14benzothiazin2yl)acetyl)amino)5propylthiophene3carboxylate
methyl2((2(3oxo6(trifluoromethyl)4H14benzothiazin2yl)acetyl)amino)5propylthiophene3carboxylate
METHYL2(2(3OXO6(TRIFLUOROMETHYL)34DIHYDRO2HBENZO(B)(14)THIAZIN2YL)ACETAMIDO)5PROPYLTHIOPHENE3CARBOXYLATE
MFCD06420720
ZINC000016899432
ZINC000016899433
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