Vitas-M small molecule compound
N-(3-methoxyphenyl)-2-[(10-phenyl-8,9-dihydro-7H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]acetamide
Catalog ID
STK553555
SMILES COc1cccc(c1)NC(=O)CSc1nnc2n1cnc1c2sc2c1c1CCCc1c(n2)c1ccccc1
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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 C28H22N6O2S2 MW 538.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22N6O2S2/c1-36-18-10-5-9-17(13-18)30-21(35)14-37-28-33-32-26-25-24(29-15-34(26)28)22-19-11-6-12-20(19)23(31-27(22)38-25)16-7-3-2-4-8-16/h2-5,7-10,13,15H,6,11-12,14H2,1H3,(H,30,35)InChIKey
LSJCWLQUQQQBBZ-UHFFFAOYSA-NSynonyms
840461-94-1840461941
COC1=CC=CC(=C1)NC(=O)CSC2=NN=C3N2C=NC4=C3SC5=NC(=C6CCCC6=C45)C7=CC=CC=C7
InChI=1SC28H22N6O2S2c13618105917(1318)3021(35)1437283332262524(291534(26)28)22191161220(19)23(3127(22)3825)167324816h257101315H6111214H21H3(H3035)
MFCD04004427
N(3methoxyphenyl)2((10phenyl89dihydro7Hcyclopenta(45)pyrido(3245)thieno(23e)(124)triazolo(43c)pyrimidin3yl)sulfanyl)acetamide
N(3methoxyphenyl)2((10phenyl89dihydro7Hcyclopenta(45)pyrido(3245)thieno(23e)(124)triazolo(43c)pyrimidin3yl)thio)acetamide
ZINC000097952606
ZINC97952606
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