Vitas-M small molecule compound
ethyl 1-methyl-5,6-diphenyl-2-(trichloromethyl)-1,5-dihydro-4lambda~4~-[1,2,4]thiadiazolo[5,1-e][1,2,4]thiadiazole-3(2H)-carboxylate
Catalog ID
STK400691
SMILES CCOC(=O)N1S2=C(N(C1C(Cl)(Cl)Cl)C)N=C(N2c1ccccc1)c1ccccc1
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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 C20H19Cl3N4O2S MW 485.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19Cl3N4O2S/c1-3-29-19(28)27-17(20(21,22)23)25(2)18-24-16(14-10-6-4-7-11-14)26(30(18)27)15-12-8-5-9-13-15/h4-13,17H,3H2,1-2H3InChIKey
VIQTUJJTOTYTLM-UHFFFAOYSA-NSynonyms
CCOC(=O)N1C(N(C2=S1N(C(=N2)C3=CC=CC=C3)C4=CC=CC=C4)C)C(Cl)(Cl)Cl
ethyl1methyl56diphenyl2(trichloromethyl)15dihydro4lambda~4~(124)thiadiazolo(51e)(124)thiadiazole3(2H)carboxylate
ETHYL1METHYL56DIPHENYL2(TRICHLOROMETHYL)15DIHYDRO4LAMBDA4(124)THIADIAZOLO(51E)(124)THIADIAZOLE3(2H)CARBOXYLATE
ethyl6methyl23diphenyl7(trichloromethyl)1$l^(4)thia2468tetrazabicyclo(330)octa1(5)3diene8carboxylate
InChI=1SC20H19Cl3N4O2Sc132919(28)2717(20(2122)23)25(2)182416(14106471114)26(30(18)27)15128591315h41317H3H212H3
MFCD05718729
ZINC000012438449
ZINC000012438451
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