Vitas-M small molecule compound
methyl 2-{[(1-butyl-3,6-dimethyl-1H-pyrazolo[3,4-b]pyridin-4-yl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STL401566
SMILES CCCCn1nc(c2c1nc(C)cc2C(=O)Nc1sc2c(c1C(=O)OC)CCCC2)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 C23H28N4O3S MW 440.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N4O3S/c1-5-6-11-27-20-18(14(3)26-27)16(12-13(2)24-20)21(28)25-22-19(23(29)30-4)15-9-7-8-10-17(15)31-22/h12H,5-11H2,1-4H3,(H,25,28)InChIKey
APNFSVFSNBCOPQ-UHFFFAOYSA-NSynonyms
866818-94-2866818942
CCCCN1C2=C(C(=N1)C)C(=CC(=N2)C)C(=O)NC3=C(C4=C(S3)CCCC4)C(=O)OC
InChI=1SC23H28N4O3Sc15611272018(14(3)2627)16(1213(2)2420)21(28)252219(23(29)304)159781017(15)3122h12H511H214H3(H2528)
methyl2(((1butyl36dimethyl1Hpyrazolo(34b)pyridin4yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2((1butyl36dimethylpyrazolo(34b)pyridine4carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
MFCD08553523
ZINC000019632333
ZINC19632333
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