Vitas-M small molecule compound
ethyl 4-({[(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)benzoate
Catalog ID
STL031937
SMILES CCOC(=O)c1ccc(cc1)NC(=O)CSc1nnc(n1c1ccccc1)CSc1nc(N)c2c(n1)sc1c2CCC1
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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 C29H27N7O3S3 MW 617.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27N7O3S3/c1-2-39-27(38)17-11-13-18(14-12-17)31-23(37)16-41-29-35-34-22(36(29)19-7-4-3-5-8-19)15-40-28-32-25(30)24-20-9-6-10-21(20)42-26(24)33-28/h3-5,7-8,11-14H,2,6,9-10,15-16H2,1H3,(H,31,37)(H2,30,32,33)InChIKey
LAULGTWXHXVDBJ-UHFFFAOYSA-NSynonyms
647819-59-8647819598
CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C3=CC=CC=C3)CSC4=NC(=C5C6=C(CCC6)SC5=N4)N
ethyl4((((5(((4amino67dihydro5Hcyclopenta(45)thieno(23d)pyrimidin2yl)sulfanyl)methyl)4phenyl4H124triazol3yl)sulfanyl)acetyl)amino)benzoate
ethyl4((2((5((1amino78dihydro6Hcyclopenta(45)thieno(12c)pyrimidin3yl)sulfanylmethyl)4phenyl124triazol3yl)sulfanyl)acetyl)amino)benzoate
ETHYL4(2((5(((4AMINO67DIHYDRO5HCYCLOPENTA(45)THIENO(23D)PYRIMIDIN2YL)THIO)METHYL)4PHENYL4H124TRIAZOL3YL)THIO)ACETAMIDO)BENZOATE
ETHYL4(2(5((4AMINO(567TRIHYDROCYCLOPENTA(12D)PYRIMIDINO(45B)THIOPHEN2YLTHIO))METHYL)4PHENYL124TRIAZOL3YLTHIO)ACETYLAMINO)BENZOATE
InChI=1SC29H27N7O3S3c123927(38)17111318(141217)3123(37)164129353422(36(29)197435819)1540283225(30)2420961021(20)4226(24)3328h35781114H269101516H21H3(H3137)(H2303233)
MFCD04081088
ZINC000006157366
ZINC6157366
Check stock
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