Vitas-M small molecule compound
2-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-12-(4-methoxyphenyl)-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol
Catalog ID
STK270817
SMILES COc1ccc(cc1)C1c2ccc(cc2Oc2c1c1nc(nn1cn2)CSc1nc2c(s1)cccc2)O
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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 C27H19N5O3S2 MW 525.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19N5O3S2/c1-34-17-9-6-15(7-10-17)23-18-11-8-16(33)12-20(18)35-26-24(23)25-30-22(31-32(25)14-28-26)13-36-27-29-19-4-2-3-5-21(19)37-27/h2-12,14,23,33H,13H2,1H3InChIKey
ZVDKMQUKYXODEB-UHFFFAOYSA-NSynonyms
845668-39-52((13benzothiazol2ylsulfanyl)methyl)12(4methoxyphenyl)12Hchromeno(32e)(124)triazolo(15c)pyrimidin9ol
2((benzo(d)thiazol2ylthio)methyl)12(4methoxyphenyl)12Hchromeno(32e)(124)triazolo(15c)pyrimidin9ol
845668395
COC1=CC=C(C=C1)C2C3=C(C=C(C=C3)O)OC4=C2C5=NC(=NN5C=N4)CSC6=NC7=CC=CC=C7S6
InChI=1SC27H19N5O3S2c134179615(71017)231811816(33)1220(18)352624(23)253022(3132(25)142826)1336272919423521(19)3727h212142333H13H21H3
MFCD04169330
ZINC000097954271
ZINC000097954272
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