Vitas-M small molecule compound
methyl 8-ethoxy-4-(morpholin-4-yl)-2-(trifluoromethyl)-2H-[1,3,5]triazino[2,1-b][1,3]benzothiazole-2-carboxylate
Catalog ID
STK776362
SMILES CCOc1ccc2c(c1)sc1=NC(N=C(n21)N1CCOCC1)(C(=O)OC)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 C18H19F3N4O4S MW 444.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19F3N4O4S/c1-3-29-11-4-5-12-13(10-11)30-16-23-17(14(26)27-2,18(19,20)21)22-15(25(12)16)24-6-8-28-9-7-24/h4-5,10H,3,6-9H2,1-2H3InChIKey
AREUBTVKKCKFGW-UHFFFAOYSA-NSynonyms
CCOC1=CC2=C(C=C1)N3C(=NC(N=C3S2)(C(=O)OC)C(F)(F)F)N4CCOCC4
InChI=1SC18H19F3N4O4Sc132911451213(1011)30162317(14(26)27218(1920)21)2215(25(12)16)2468289724h4510H369H212H3
methyl8ethoxy4(morpholin4yl)2(trifluoromethyl)2H(135)triazino(21b)(13)benzothiazole2carboxylate
METHYL8ETHOXY4MORPHOLIN4YL2(TRIFLUOROMETHYL)(135)TRIAZINO(21B)(13)BENZOTHIAZOLE2CARBOXYLATE
MFCD05258919
ZINC000012412268
ZINC000012412269
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