Vitas-M small molecule compound

3-amino-4-(3,4-dimethylphenyl)-N-(4-methoxy-2-nitrophenyl)-6-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide

Catalog ID
STK307719
SMILES COc1ccc(c(c1)[N+](=O)[O-])NC(=O)c1sc2c(c1N)c(cc(n2)C(F)(F)F)c1ccc(c(c1)C)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 C24H19F3N4O4S MW 516.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19F3N4O4S/c1-11-4-5-13(8-12(11)2)15-10-18(24(25,26)27)30-23-19(15)20(28)21(36-23)22(32)29-16-7-6-14(35-3)9-17(16)31(33)34/h4-10H,28H2,1-3H3,(H,29,32)
InChIKey
SXJATTNFEYIDKB-UHFFFAOYSA-N
Synonyms
828294-13-9
3amino4(34dimethylphenyl)N(4methoxy2nitrophenyl)6(trifluoromethyl)thieno(23b)pyridine2carboxamide
828294139
CC1=C(C=C(C=C1)C2=CC(=NC3=C2C(=C(S3)C(=O)NC4=C(C=C(C=C4)OC)(N+)(=O)(O))N)C(F)(F)F)C
COc1ccc(c(c1)(N+)(=O)(O))NC(=O)c1sc2c(c1N)c(cc(n2)C(F)(F)F)c1ccc(c(c1)C)C
InChI=1SC24H19F3N4O4Sc1114513(812(11)2)151018(24(2526)27)302319(15)20(28)21(3623)22(32)29167614(353)917(16)31(33)34h410H28H213H3(H2932)
MFCD04131131
ZINC000013959901
ZINC13959901

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.