Vitas-M small molecule compound
[3-amino-4-(trifluoromethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]thieno[3,2-e]pyridin-2-yl](3,4-dihydroisoquinolin-2(1H)-yl)methanone
Catalog ID
STL006165
SMILES O=C(c1sc2c(c1N)c(c1c(n2)CCCCC1)C(F)(F)F)N1CCc2c(C1)cccc2
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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 C23H22F3N3OS MW 445.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22F3N3OS/c24-23(25,26)18-15-8-2-1-3-9-16(15)28-21-17(18)19(27)20(31-21)22(30)29-11-10-13-6-4-5-7-14(13)12-29/h4-7H,1-3,8-12,27H2InChIKey
HDDQWELEEGSKNN-UHFFFAOYSA-NSynonyms
626221-75-8(3amino4(trifluoromethyl)6789tetrahydro5Hcyclohepta(b)thieno(32e)pyridin2yl)(34dihydroisoquinolin2(1H)yl)methanone
626221758
C1CCC2=C(CC1)N=C3C(=C2C(F)(F)F)C(=C(S3)C(=O)N4CCC5=CC=CC=C5C4)N
InChI=1SC23H22F3N3OSc2423(2526)18158213916(15)282117(18)19(27)20(3121)22(30)29111013645714(13)1229h47H1381227H2
MFCD03697908
ZINC000000663859
ZINC00663859
ZINC663859
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