Vitas-M small molecule compound
3-(5,10-dimethyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)propanoic acid
Catalog ID
STK598512
SMILES CC1CCc2c(C1)c1c(s2)nc(n2c1nc(n2)CCC(=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 C16H18N4O2S MW 330.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N4O2S/c1-8-3-4-11-10(7-8)14-15-18-12(5-6-13(21)22)19-20(15)9(2)17-16(14)23-11/h8H,3-7H2,1-2H3,(H,21,22)InChIKey
CKRPAEVLWAWWMG-UHFFFAOYSA-NSynonyms
896818-01-23(510dimethyl891011tetrahydro(1)benzothieno(32e)(124)triazolo(15c)pyrimidin2yl)propanoicacid
3(510dimethyl891011tetrahydrobenzo(45)thieno(32e)(124)triazolo(15c)pyrimidin2yl)propanoicacid
896818012
CC1CCC2=C(C1)C3=C(S2)N=C(N4C3=NC(=N4)CCC(=O)O)C
InChI=1SC16H18N4O2Sc18341110(78)14151812(5613(21)22)1920(15)9(2)1716(14)2311h8H37H212H3(H2122)
MFCD06597279
ZINC000002208319
ZINC000002208321
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