Vitas-M small molecule compound
(2E)-N-{5-amino-1-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-1H-1,2,4-triazol-3-yl}-3-(2-methoxyphenyl)prop-2-enamide
Catalog ID
STL010219
SMILES COc1ccccc1/C=C/C(=O)Nc1nn(c(n1)N)c1scc(n1)c1ccc(cc1)Cl
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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 C21H17ClN6O2S MW 452.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17ClN6O2S/c1-30-17-5-3-2-4-14(17)8-11-18(29)25-20-26-19(23)28(27-20)21-24-16(12-31-21)13-6-9-15(22)10-7-13/h2-12H,1H3,(H3,23,25,26,27,29)/b11-8+InChIKey
VWODNTWOCQYGSX-DHZHZOJOSA-NSynonyms
929963-41-7(2E)N(5amino1(4(4chlorophenyl)13thiazol2yl)1H124triazol3yl)3(2methoxyphenyl)prop2enamide
(E)N(5amino1(4(4chlorophenyl)13thiazol2yl)124triazol3yl)3(2methoxyphenyl)prop2enamide
(E)N(5amino1(4(4chlorophenyl)thiazol2yl)1H124triazol3yl)3(2methoxyphenyl)acrylamide
929963417
COC1=CC=CC=C1C=CC(=O)NC2=NN(C(=N2)N)C3=NC(=CS3)C4=CC=C(C=C4)Cl
COc1ccccc1C=CC(=O)Nc1nn(c(n1)N)c1scc(n1)c1ccc(cc1)Cl
InChI=1SC21H17ClN6O2Sc13017532414(17)81118(29)25202619(23)28(2720)212416(123121)136915(22)10713h212H1H3(H32325262729)b118+
MFCD09849445
ZINC000013681821
ZINC13681821
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