Vitas-M small molecule compound
methyl 2-({[1,3-dimethyl-6-(1,3,5-trimethyl-1H-pyrazol-4-yl)-1H-pyrazolo[3,4-b]pyridin-4-yl]carbonyl}amino)-5-methylthiophene-3-carboxylate
Catalog ID
STL397471
SMILES COC(=O)c1cc(sc1NC(=O)c1cc(nc2c1c(C)nn2C)c1c(C)nn(c1C)C)C
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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 C22H24N6O3S MW 452.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N6O3S/c1-10-8-15(22(30)31-7)21(32-10)24-20(29)14-9-16(17-11(2)25-27(5)13(17)4)23-19-18(14)12(3)26-28(19)6/h8-9H,1-7H3,(H,24,29)InChIKey
GEHCNRNEKOAODU-UHFFFAOYSA-NSynonyms
1006344-93-91006344939
CC1=CC(=C(S1)NC(=O)C2=CC(=NC3=C2C(=NN3C)C)C4=C(N(N=C4C)C)C)C(=O)OC
InChI=1SC22H24N6O3Sc110815(22(30)317)21(3210)2420(29)14916(1711(2)2527(5)13(17)4)231918(14)12(3)2628(19)6h89H17H3(H2429)
METHYL2(((13DIMETHYL6(135TRIMETHYL1HPYRAZOL4YL)1HPYRAZOLO(34B)PYRIDIN4YL)CARBONYL)AMINO)5METHYLTHIOPHENE3CARBOXYLATE
methyl2((13dimethyl6(135trimethylpyrazol4yl)pyrazolo(34b)pyridine4carbonyl)amino)5methylthiophene3carboxylate
MFCD08553719
ZINC000020606315
ZINC20606315
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