Vitas-M small molecule compound
ethyl 2-({[(5-{[(4-amino-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}amino)-4,5-dimethylthiophene-3-carboxylate
Catalog ID
STK562349
SMILES CCOC(=O)c1c(NC(=O)CSc2nnc(n2c2ccccc2)CSc2nc(N)c3c(n2)sc2c3CCC2)sc(c1C)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 C29H29N7O3S4 MW 651.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29N7O3S4/c1-4-39-27(38)22-15(2)16(3)42-25(22)31-21(37)14-41-29-35-34-20(36(29)17-9-6-5-7-10-17)13-40-28-32-24(30)23-18-11-8-12-19(18)43-26(23)33-28/h5-7,9-10H,4,8,11-14H2,1-3H3,(H,31,37)(H2,30,32,33)InChIKey
NHWAJWGFTTWFLJ-UHFFFAOYSA-NSynonyms
647819-70-3CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CSC2=NN=C(N2C3=CC=CC=C3)CSC4=NC(=C5C6=C(CCC6)SC5=N4)N
ethyl2((((5(((4amino67dihydro5Hcyclopenta(45)thieno(23d)pyrimidin2yl)sulfanyl)methyl)4phenyl4H124triazol3yl)sulfanyl)acetyl)amino)45dimethylthiophene3carboxylate
ethyl2((2((5((1amino78dihydro6Hcyclopenta(45)thieno(12c)pyrimidin3yl)sulfanylmethyl)4phenyl124triazol3yl)sulfanyl)acetyl)amino)45dimethylthiophene3carboxylate
ETHYL2(2((5(((4AMINO67DIHYDRO5HCYCLOPENTA(45)THIENO(23D)PYRIMIDIN2YL)THIO)METHYL)4PHENYL4H124TRIAZOL3YL)THIO)ACETAMIDO)45DIMETHYLTHIOPHENE3CARBOXYLATE
ETHYL2(2(5((4AMINO(567TRIHYDROCYCLOPENTA(12D)PYRIMIDINO(45B)THIOPHEN2YLTHIO))METHYL)4PHENYL(124TRIAZOL3YLTHIO))ACETYLAMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE
Registry IDs
MFCD04078135ZINC000097986543
ZINC97986543
Check stock
See real-time availability and sample size for STK562349 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.