Vitas-M small molecule compound
(4bS,7aR,8S)-8-(phenylcarbonyl)-6-[3-(trifluoromethyl)phenyl]-7a,8-dihydro-4aH-pyrrolo[3',4':3,4]pyrrolo[1,2-b]pyridazine-5,7(4bH,6H)-dione
Catalog ID
STK547642
SMILES O=C1N(c2cccc(c2)C(F)(F)F)C(=O)[C@H]2[C@@H]1[C@H](N1C2C=CC=N1)C(=O)c1ccccc1
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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 C23H16F3N3O3 MW 439.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16F3N3O3/c24-23(25,26)14-8-4-9-15(12-14)28-21(31)17-16-10-5-11-27-29(16)19(18(17)22(28)32)20(30)13-6-2-1-3-7-13/h1-12,16-19H/t16?,17-,18-,19+/m1/s1InChIKey
ZENRFZDTAOHQSD-MSRNWOCLSA-NSynonyms
(3aR4S9bS)4benzoyl2(3(trifluoromethyl)phenyl)3a49a9btetrahydropyrrolo(12)pyrrolo(35b)pyridazine13dione
(4aR4bS7aR8S)8benzoyl6(3(trifluoromethyl)phenyl)7a8dihydro4aHpyrrolo(3434)pyrrolo(12b)pyridazine57(4bH6H)dione
(4bS7aR8S)8(phenylcarbonyl)6(3(trifluoromethyl)phenyl)7a8dihydro4aHpyrrolo(3434)pyrrolo(12b)pyridazine57(4bH6H)dione
C1=CC=C(C=C1)C(=O)C2C3C(C4N2N=CC=C4)C(=O)N(C3=O)C5=CC=CC(=C5)C(F)(F)F
InChI=1SC23H16F3N3O3c2423(2526)1484915(1214)2821(31)1716105112729(16)19(18(17)22(28)32)20(30)136213713h1121619Ht16?171819+m1s1
MFCD18157888
O=C1N(c2cccc(c2)C(F)(F)F)C(=O)(C@H)2(C@@H)1(C@H)(N1(C@@H)2C=CC=N1)C(=O)c1ccccc1
O=C1N(c2cccc(c2)C(F)(F)F)C(=O)(C@H)2(C@@H)1(C@H)(N1C2C=CC=N1)C(=O)c1ccccc1
ZINC000009066479
ZINC000039327596
Check stock
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Check stock on Vitas-MAvailable files
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