Vitas-M small molecule compound
methyl (2Z)-2-{[(1'-ethyl-3',5'-dimethyl-1H,1'H-3,4'-bipyrazol-5-yl)carbonyl]imino}-5-methyl-2,3-dihydro-1,3-thiazole-4-carboxylate
Catalog ID
STL319698
SMILES COC(=O)c1[nH]/c(=N/C(=O)c2[nH]nc(c2)c2c(C)nn(c2C)CC)/sc1C
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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 C17H20N6O3S MW 388.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N6O3S/c1-6-23-9(3)13(8(2)22-23)11-7-12(21-20-11)15(24)19-17-18-14(10(4)27-17)16(25)26-5/h7H,6H2,1-5H3,(H,20,21)(H,18,19,24)InChIKey
XJQBYPOEWYMUJF-UHFFFAOYSA-NSynonyms
1491131-41-91491131419
COC(=O)c1(nH)c(=NC(=O)c2(nH)nc(c2)c2c(C)nn(c2C)CC)sc1C
methyl(2Z)2(((1ethyl35dimethyl1H1H34bipyrazol5yl)carbonyl)imino)5methyl23dihydro13thiazole4carboxylate
MFCD28029076
ZINC000095480265
ZINC95480265
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