Vitas-M small molecule compound
9-(difluoromethyl)-2-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-7-methylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Catalog ID
STL395556
SMILES FC(c1cc(C)c2c(n1)sc1c2ncn2c1nc(n2)Cn1nc(c(c1C)[N+](=O)[O-])C)F
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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 C18H14F2N8O2S MW 444.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14F2N8O2S/c1-7-4-10(16(19)20)22-18-12(7)13-15(31-18)17-23-11(25-27(17)6-21-13)5-26-9(3)14(28(29)30)8(2)24-26/h4,6,16H,5H2,1-3H3InChIKey
WQTUJCVJRMJOFL-UHFFFAOYSA-NSynonyms
1006995-88-51006995885
9(difluoromethyl)2((35dimethyl4nitro1Hpyrazol1yl)methyl)7methylpyrido(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(F)F
FC(c1cc(C)c2c(n1)sc1c2ncn2c1nc(n2)Cn1nc(c(c1C)(N+)(=O)(O))C)F
InChI=1SC18H14F2N8O2Sc17410(16(19)20)221812(7)1315(3118)172311(2527(17)62113)5269(3)14(28(29)30)8(2)2426h4616H5H213H3
MFCD08554201
ZINC000019640198
ZINC19640198
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