Vitas-M small molecule compound
methyl 9-methyl-2-[(4-nitrophenoxy)methyl]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
Catalog ID
STL177122
SMILES COC(=O)c1sc2c(c1C)c1nc(nn1cn2)COc1ccc(cc1)[N+](=O)[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 C17H13N5O5S MW 399.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13N5O5S/c1-9-13-15-19-12(7-27-11-5-3-10(4-6-11)22(24)25)20-21(15)8-18-16(13)28-14(9)17(23)26-2/h3-6,8H,7H2,1-2H3InChIKey
WDMBBGKJARKGAY-UHFFFAOYSA-NSynonyms
828285-31-0828285310
CC1=C(SC2=C1C3=NC(=NN3C=N2)COC4=CC=C(C=C4)(N+)(=O)(O))C(=O)OC
COC(=O)c1sc2c(c1C)c1nc(nn1cn2)COc1ccc(cc1)(N+)(=O)(O)
InChI=1SC17H13N5O5Sc1913151912(727115310(4611)22(24)25)2021(15)81816(13)2814(9)17(23)262h368H7H212H3
methyl9methyl2((4nitrophenoxy)methyl)thieno(32e)(124)triazolo(15c)pyrimidine8carboxylate
MFCD04130267
ZINC000002791984
ZINC02791984
ZINC2791984
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