Vitas-M small molecule compound
methyl 2-{[(1-butyl-3,6-dimethyl-1H-pyrazolo[3,4-b]pyridin-4-yl)carbonyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Catalog ID
STK315009
SMILES CCCCn1nc(c2c1nc(C)cc2C(=O)Nc1sc2c(c1C(=O)OC)CCCCC2)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 C24H30N4O3S MW 454.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H30N4O3S/c1-5-6-12-28-21-19(15(3)27-28)17(13-14(2)25-21)22(29)26-23-20(24(30)31-4)16-10-8-7-9-11-18(16)32-23/h13H,5-12H2,1-4H3,(H,26,29)InChIKey
MHGZBRUNSHWMSY-UHFFFAOYSA-NSynonyms
881475-56-5881475565
CCCCN1C2=C(C(=N1)C)C(=CC(=N2)C)C(=O)NC3=C(C4=C(S3)CCCCC4)C(=O)OC
InChI=1SC24H30N4O3Sc15612282119(15(3)2728)17(1314(2)2521)22(29)262320(24(30)314)16108791118(16)3223h13H512H214H3(H2629)
methyl2(((1butyl36dimethyl1Hpyrazolo(34b)pyridin4yl)carbonyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
methyl2((1butyl36dimethylpyrazolo(34b)pyridine4carbonyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
MFCD08554020
ZINC000013961291
ZINC13961291
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