Vitas-M small molecule compound
ethyl 5-(1,3-benzothiazol-2-ylamino)-2-methyl-4-oxo-5-(trifluoromethyl)-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STL346240
SMILES CCOC(=O)C1=C(C)NC(C1=O)(Nc1nc2c(s1)cccc2)C(F)(F)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 C16H14F3N3O3S MW 385.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14F3N3O3S/c1-3-25-13(24)11-8(2)21-15(12(11)23,16(17,18)19)22-14-20-9-6-4-5-7-10(9)26-14/h4-7,21H,3H2,1-2H3,(H,20,22)InChIKey
AOZZGOHITMSTFR-UHFFFAOYSA-NSynonyms
1HPYRROLE3CARBOXYLICACID5(13BENZOTHIAZOL2YLAMINO)45DIHYDRO2METHYL4OXO5(TRIFLUOROMETHYL)ETHYLESTER
5(BENZOTHIAZOL2YLAMINO)2METHYL4OXO5TRIFLUOROMETHYL45DIHYDRO1HPYRROLE3CARBOXYLICACIDETHYLESTER
CCOC(=O)C1=C(NC(C1=O)(C(F)(F)F)NC2=NC3=CC=CC=C3S2)C
ETHYL5(13BENZOTHIAZOL2YLAMINO)2METHYL4OXO5(TRIFLUOROMETHYL)1HPYRROLE3CARBOXYLATE
ethyl5(13benzothiazol2ylamino)2methyl4oxo5(trifluoromethyl)45dihydro1Hpyrrole3carboxylate
ethyl5(benzo(d)thiazol2ylamino)2methyl4oxo5(trifluoromethyl)45dihydro1Hpyrrole3carboxylate
InChI=1SC16H14F3N3O3Sc132513(24)118(2)2115(12(11)2316(1718)19)2214209645710(9)2614h4721H3H212H3(H2022)
MFCD04196672
ZINC000100999825
ZINC000100999827
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