Vitas-M small molecule compound
[3-amino-4-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridin-2-yl](6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methanone
Catalog ID
STK850417
SMILES COc1cc2CCN(Cc2cc1OC)C(=O)c1sc2c(c1N)c(c1c(n2)CCC1)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 C23H22F3N3O3S MW 477.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22F3N3O3S/c1-31-15-8-11-6-7-29(10-12(11)9-16(15)32-2)22(30)20-19(27)17-18(23(24,25)26)13-4-3-5-14(13)28-21(17)33-20/h8-9H,3-7,10,27H2,1-2H3InChIKey
OICVWOHZJNQFKR-UHFFFAOYSA-NSynonyms
627053-27-4(3AMINO4(TRIFLUOROMETHYL)67DIHYDRO5HCYCLOPENTA(B)THIENO(32E)PYRIDIN2YL)(67DIMETHOXY34DIHYDRO2(1H)ISOQUINOLINYL)METHANONE
(3amino4(trifluoromethyl)67dihydro5Hcyclopenta(b)thieno(32e)pyridin2yl)(67dimethoxy34dihydroisoquinolin2(1H)yl)methanone
2((67DIMETHOXY34DIHYDROISOQUINOLIN2(1H)YL)CARBONYL)4(TRIFLUOROMETHYL)67DIHYDRO5HCYCLOPENTA(B)THIENO(32E)PYRIDIN3YLAMINE
627053274
COC1=C(C=C2CN(CCC2=C1)C(=O)C3=C(C4=C(C5=C(CCC5)N=C4S3)C(F)(F)F)N)OC
InChI=1SC23H22F3N3O3Sc131158116729(1012(11)916(15)322)22(30)2019(27)1718(23(2425)26)1343514(13)2821(17)3320h89H371027H212H3
MFCD03784550
ZINC000006396466
ZINC06396466
ZINC6396466
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