Vitas-M small molecule compound

3-amino-N-(3,4-dimethoxyphenyl)-6-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-4-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide

Catalog ID
STK997364
SMILES COc1cc(ccc1OC)NC(=O)c1sc2c(c1N)c(cc(n2)C12CC3CC(C2)CC(C1)C3)C(F)(F)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 C27H28F3N3O3S MW 531.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28F3N3O3S/c1-35-18-4-3-16(8-19(18)36-2)32-24(34)23-22(31)21-17(27(28,29)30)9-20(33-25(21)37-23)26-10-13-5-14(11-26)7-15(6-13)12-26/h3-4,8-9,13-15H,5-7,10-12,31H2,1-2H3,(H,32,34)
InChIKey
PYRHCFLPVCSEIP-UHFFFAOYSA-N
Synonyms
488119-86-4
3aminoN(34dimethoxyphenyl)6(tricyclo(3311~37~)dec1yl)4(trifluoromethyl)thieno(23b)pyridine2carboxamide
488119864
6((3r5r7r)adamantan1yl)3aminoN(34dimethoxyphenyl)4(trifluoromethyl)thieno(23b)pyridine2carboxamide
6(1ADAMANTYL)3AMINON(34DIMETHOXYPHENYL)4(TRIFLUOROMETHYL)THIENO(23B)PYRIDINE2CARBOXAMIDE
COC1=C(C=C(C=C1)NC(=O)C2=C(C3=C(S2)N=C(C=C3C(F)(F)F)C45CC6CC(C4)CC(C6)C5)N)OC
InChI=1SC27H28F3N3O3Sc135184316(819(18)362)3224(34)2322(31)2117(27(2829)30)920(3325(21)3723)261013514(1126)715(613)1226h34891315H57101231H212H3(H3234)
ZINC000008451169
ZINC8451169

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Available files

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