Vitas-M small molecule compound
1-phenyl-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]ethanone
Catalog ID
STK553837
SMILES O=C(c1ccccc1)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 C27H19N5OS2 MW 493.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19N5OS2/c33-20(16-8-3-1-4-9-16)14-34-27-31-30-25-24-23(28-15-32(25)27)21-18-12-7-13-19(18)22(29-26(21)35-24)17-10-5-2-6-11-17/h1-6,8-11,15H,7,12-14H2InChIKey
YFPKUJTZCVPHQQ-UHFFFAOYSA-NSynonyms
840463-94-71phenyl2((10phenyl89dihydro7Hcyclopenta(45)pyrido(3245)thieno(23e)(124)triazolo(43c)pyrimidin3yl)sulfanyl)ethanone
1phenyl2((10phenyl89dihydro7Hcyclopenta(45)pyrido(3245)thieno(23e)(124)triazolo(43c)pyrimidin3yl)thio)ethanone
840463947
C1CC2=C3C4=C(C5=NN=C(N5C=N4)SCC(=O)C6=CC=CC=C6)SC3=NC(=C2C1)C7=CC=CC=C7
InChI=1SC27H19N5OS2c3320(168314916)1434273130252423(281532(25)27)21181271319(18)22(2926(21)3524)17105261117h1681115H71214H2
MFCD04004821
ZINC000009461765
ZINC09461765
ZINC9461765
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