Vitas-M small molecule compound
2-{5-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]furan-2-yl}-9-ethyl-8-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Catalog ID
STL403263
SMILES CCc1c(C)sc2c1c1nc(nn1cn2)c1ccc(o1)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 C20H19N7O3S MW 437.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N7O3S/c1-5-14-12(4)31-20-16(14)19-22-18(24-26(19)9-21-20)15-7-6-13(30-15)8-25-11(3)17(27(28)29)10(2)23-25/h6-7,9H,5,8H2,1-4H3InChIKey
DHBFERPIVVBDCM-UHFFFAOYSA-NSynonyms
1005699-62-61005699626
2(5((35dimethyl4nitro1Hpyrazol1yl)methyl)furan2yl)9ethyl8methylthieno(32e)(124)triazolo(15c)pyrimidine
CCC1=C(SC2=C1C3=NC(=NN3C=N2)C4=CC=C(O4)CN5C(=C(C(=N5)C)(N+)(=O)(O))C)C
CCc1c(C)sc2c1c1nc(nn1cn2)c1ccc(o1)Cn1nc(c(c1C)(N+)(=O)(O))C
InChI=1SC20H19N7O3Sc151412(4)312016(14)192218(2426(19)92120)157613(3015)82511(3)17(27(28)29)10(2)2325h679H58H214H3
MFCD04056338
ZINC000002790280
ZINC02790280
ZINC2790280
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