Vitas-M small molecule compound
(1Z)-1-(4-methoxyphenyl)-N-(8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-ylmethoxy)ethanimine
Catalog ID
STL252802
SMILES COc1ccc(cc1)/C(=N\OCc1nn2c(n1)c1c(nc2)sc2c1CCCC2)/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 C21H21N5O2S MW 407.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5O2S/c1-13(14-7-9-15(27-2)10-8-14)25-28-11-18-23-20-19-16-5-3-4-6-17(16)29-21(19)22-12-26(20)24-18/h7-10,12H,3-6,11H2,1-2H3/b25-13-InChIKey
OFWRUJDHOWVTBL-MXAYSNPKSA-NSynonyms
586997-58-2(1Z)1(4methoxyphenyl)N(891011tetrahydro(1)benzothieno(32e)(124)triazolo(15c)pyrimidin2ylmethoxy)ethanimine
(Z)1(4methoxyphenyl)ethanoneO((891011tetrahydrobenzo(45)thieno(32e)(124)triazolo(15c)pyrimidin2yl)methyl)oxime
586997582
CC(=NOCC1=NN2C=NC3=C(C2=N1)C4=C(S3)CCCC4)C5=CC=C(C=C5)OC
COc1ccc(cc1)C(=NOCc1nn2c(n1)c1c(nc2)sc2c1CCCC2)C
InChI=1SC21H21N5O2Sc113(147915(272)10814)2528111823201916534617(16)2921(19)221226(20)2418h71012H3611H212H3b2513
MFCD03869279
ZINC000004204832
ZINC20160091
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