Vitas-M small molecule compound
(6aS,6bR,9aS,10R)-10-(1H-benzotriazol-1-ylcarbonyl)-8-[3-(trifluoromethyl)phenyl]-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Catalog ID
STK546273
SMILES O=C1N(c2cccc(c2)C(F)(F)F)C(=O)[C@@H]2[C@H]1[C@@H](N1[C@H]2C=Cc2c1cccc2)C(=O)n1nnc2c1cccc2
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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 C28H18F3N5O3 MW 529.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H18F3N5O3/c29-28(30,31)16-7-5-8-17(14-16)34-25(37)22-21-13-12-15-6-1-3-10-19(15)35(21)24(23(22)26(34)38)27(39)36-20-11-4-2-9-18(20)32-33-36/h1-14,21-24H/t21-,22-,23-,24+/m0/s1InChIKey
DALKPDWSIKEYEL-NEWJYFPISA-NSynonyms
956982-19-7(6aS6bR9aS10R)10(1Hbenzo(d)(123)triazole1carbonyl)8(3(trifluoromethyl)phenyl)9a10dihydro6aHpyrrolo(3434)pyrrolo(12a)quinoline79(6bH8H)dione
(6aS6bR9aS10R)10(1Hbenzotriazol1ylcarbonyl)8(3(trifluoromethyl)phenyl)9a10dihydro6aHpyrrolo(3434)pyrrolo(12a)quinoline79(6bH8H)dione
956982197
C1=CC=C2C(=C1)C=CC3N2C(C4C3C(=O)N(C4=O)C5=CC=CC(=C5)C(F)(F)F)C(=O)N6C7=CC=CC=C7N=N6
InChI=1SC28H18F3N5O3c2928(3031)1675817(1416)3425(37)22211312156131019(15)35(21)24(23(22)26(34)38)27(39)36201142918(20)323336h1142124Ht21222324+m0s1
MFCD18242280
O=C1N(c2cccc(c2)C(F)(F)F)C(=O)(C@@H)2(C@H)1(C@@H)(N1(C@H)2C=Cc2c1cccc2)C(=O)n1nnc2c1cccc2
ZINC000100858892
ZINC100858892
Check stock
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Check stock on Vitas-MAvailable files
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