Vitas-M small molecule compound
ethyl 5-[(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)carbamoyl]-1-methyl-1H-pyrazole-3-carboxylate
Catalog ID
STK956022
SMILES CCOC(=O)c1cc(n(n1)C)C(=O)Nc1sc2c(c1C#N)CCC2
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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 C16H16N4O3S MW 344.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N4O3S/c1-3-23-16(22)11-7-12(20(2)19-11)14(21)18-15-10(8-17)9-5-4-6-13(9)24-15/h7H,3-6H2,1-2H3,(H,18,21)InChIKey
DQFQBIATIYZVSC-UHFFFAOYSA-NSynonyms
1005595-98-11005595981
CCOC(=O)C1=NN(C(=C1)C(=O)NC2=C(C3=C(S2)CCC3)C#N)C
ethyl5((3cyano56dihydro4Hcyclopenta(b)thiophen2yl)carbamoyl)1methyl1Hpyrazole3carboxylate
ETHYL5((3CYANO56DIHYDRO4HCYCLOPENTA(B)THIOPHEN2YL)CARBAMOYL)1METHYLPYRAZOLE3CARBOXYLATE
InChI=1SC16H16N4O3Sc132316(22)11712(20(2)1911)14(21)181510(817)954613(9)2415h7H36H212H3(H1821)
MFCD03074052
ZINC000002735901
ZINC02735901
ZINC2735901
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