Vitas-M small molecule compound
2-{[5-(6-cyclopropyl-1,3-dimethyl-1H-pyrazolo[3,4-b]pyridin-4-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methyl-4-oxo-6,7-dihydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-3(5H)-yl)acetamide
Catalog ID
STL400259
SMILES CCn1c(SCC(=O)Nn2c(C)nc3c(c2=O)c2CCCc2s3)nnc1c1cc(nc2c1c(C)nn2C)C1CC1
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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 C27H29N9O2S2 MW 575.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N9O2S2/c1-5-35-23(17-11-18(15-9-10-15)29-24-21(17)13(2)32-34(24)4)30-31-27(35)39-12-20(37)33-36-14(3)28-25-22(26(36)38)16-7-6-8-19(16)40-25/h11,15H,5-10,12H2,1-4H3,(H,33,37)InChIKey
HJKRQGUNVPFVKY-UHFFFAOYSA-NSynonyms
938010-35-62((5(6cyclopropyl13dimethyl1Hpyrazolo(34b)pyridin4yl)4ethyl4H124triazol3yl)sulfanyl)N(2methyl4oxo67dihydro4Hcyclopenta(45)thieno(23d)pyrimidin3(5H)yl)acetamide
2((5(6cyclopropyl13dimethylpyrazolo(34b)pyridin4yl)4ethyl124triazol3yl)sulfanyl)N(3methyl1oxo78dihydro6Hcyclopenta(23)thieno(24d)pyrimidin2yl)acetamide
938010356
CCN1C(=NN=C1SCC(=O)NN2C(=NC3=C(C2=O)C4=C(S3)CCC4)C)C5=CC(=NC6=C5C(=NN6C)C)C7CC7
InChI=1SC27H29N9O2S2c153523(171118(1591015)292421(17)13(2)3234(24)4)303127(35)391220(37)333614(3)282522(26(36)38)1676819(16)4025h1115H51012H214H3(H3337)
MFCD08556741
ZINC000098046243
ZINC98046243
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