Vitas-M small molecule compound
2-(5,11-dimethyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)benzoic acid
Catalog ID
STK600362
SMILES CC1CCCc2c1c1c(s2)nc(n2c1nc(n2)c1ccccc1C(=O)O)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 C20H18N4O2S MW 378.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N4O2S/c1-10-6-5-9-14-15(10)16-18-22-17(12-7-3-4-8-13(12)20(25)26)23-24(18)11(2)21-19(16)27-14/h3-4,7-8,10H,5-6,9H2,1-2H3,(H,25,26)InChIKey
ZXXHFLDGSOXBHV-UHFFFAOYSA-NSynonyms
896810-91-62(511dimethyl891011tetrahydro(1)benzothieno(32e)(124)triazolo(15c)pyrimidin2yl)benzoicacid
2(511dimethyl891011tetrahydrobenzo(45)thieno(32e)(124)triazolo(15c)pyrimidin2yl)benzoicacid
896810916
CC1CCCC2=C1C3=C(S2)N=C(N4C3=NC(=N4)C5=CC=CC=C5C(=O)O)C
InChI=1SC20H18N4O2Sc1106591415(10)16182217(12734813(12)20(25)26)2324(18)11(2)2119(16)2714h347810H569H212H3(H2526)
MFCD06595741
ZINC000002201269
ZINC000002201271
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