Vitas-M small molecule compound
2-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-7,9-dimethylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Catalog ID
STK314729
SMILES Cc1cc(C)c2c(n1)sc1c2ncn2c1nc(n2)Cn1nc(c(c1C)[N+](=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 C18H16N8O2S MW 408.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N8O2S/c1-8-5-9(2)20-18-13(8)14-16(29-18)17-21-12(23-25(17)7-19-14)6-24-11(4)15(26(27)28)10(3)22-24/h5,7H,6H2,1-4H3InChIKey
XBVITKOPMLSHFE-UHFFFAOYSA-NSynonyms
1005671-72-61005671726
2((35dimethyl4nitro1Hpyrazol1yl)methyl)79dimethylpyrido(3245)thieno(23e)(124)triazolo(15c)pyrimidine
CC1=CC(=NC2=C1C3=C(S2)C4=NC(=NN4C=N3)CN5C(=C(C(=N5)C)(N+)(=O)(O))C)C
Cc1cc(C)c2c(n1)sc1c2ncn2c1nc(n2)Cn1nc(c(c1C)(N+)(=O)(O))C
InChI=1SC18H16N8O2Sc1859(2)201813(8)1416(2918)172112(2325(17)71914)62411(4)15(26(27)28)10(3)2224h57H6H214H3
MFCD06197053
ZINC000013961066
ZINC13961066
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