Vitas-M small molecule compound

2-[(11aS)-5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl]-N-[3-(trifluoromethyl)phenyl]acetamide

Catalog ID
STK606351
SMILES O=C(CN1C(=O)[C@@H]2CCCN2C(=O)c2c1cccc2)Nc1cccc(c1)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 C21H18F3N3O3 MW 417.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18F3N3O3/c22-21(23,24)13-5-3-6-14(11-13)25-18(28)12-27-16-8-2-1-7-15(16)19(29)26-10-4-9-17(26)20(27)30/h1-3,5-8,11,17H,4,9-10,12H2,(H,25,28)/t17-/m0/s1
InChIKey
WZLPVGPIEOTVNU-KRWDZBQOSA-N
Synonyms
1013751-58-0
(S)2(511dioxo231111atetrahydro1Hbenzo(e)pyrrolo(12a)(14)diazepin10(5H)yl)N(3(trifluoromethyl)phenyl)acetamide
1013751580
2((11aS)511dioxo231111atetrahydro1Hpyrrolo(21c)(14)benzodiazepin10(5H)yl)N(3(trifluoromethyl)phenyl)acetamide
2((6aS)611dioxo6a789tetrahydropyrrolo(21c)(14)benzodiazepin5yl)N(3(trifluoromethyl)phenyl)acetamide
C1CC2C(=O)N(C3=CC=CC=C3C(=O)N2C1)CC(=O)NC4=CC=CC(=C4)C(F)(F)F
InChI=1SC21H18F3N3O3c2221(2324)1353614(1113)2518(28)122716821715(16)19(29)26104917(26)20(27)30h13581117H491012H2(H2528)t17m0s1
MFCD08749761
O=C(CN1C(=O)(C@@H)2CCCN2C(=O)c2c1cccc2)Nc1cccc(c1)C(F)(F)F
ZINC000009418587
ZINC09418587
ZINC9418587

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Available files

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