Vitas-M small molecule compound
(4aR,4bS,7aR,8S)-8-(2,2-dimethylpropanoyl)-6-(4-fluorophenyl)-7a,8-dihydro-4aH-pyrrolo[3',4':3,4]pyrrolo[1,2-b]pyridazine-5,7(4bH,6H)-dione
Catalog ID
STK558650
SMILES Fc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2C=CC=N1)C(=O)C(C)(C)C
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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 C20H20FN3O3 MW 369.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20FN3O3/c1-20(2,3)17(25)16-15-14(13-5-4-10-22-24(13)16)18(26)23(19(15)27)12-8-6-11(21)7-9-12/h4-10,13-16H,1-3H3/t13-,14-,15-,16+/m1/s1InChIKey
IICLSTHDBURUGS-FPCVCCKLSA-NSynonyms
1212457-90-3(3aR4S9aR9bS)4(22dimethylpropanoyl)2(4fluorophenyl)3a49a9btetrahydropyrrolo(12)pyrrolo(35b)pyridazine13dione
(4aR4bS7aR8S)6(4fluorophenyl)8pivaloyl7a8dihydro4aHpyrrolo(3434)pyrrolo(12b)pyridazine57(4bH6H)dione
(4aR4bS7aR8S)8(22dimethylpropanoyl)6(4fluorophenyl)7a8dihydro4aHpyrrolo(3434)pyrrolo(12b)pyridazine57(4bH6H)dione
1212457903
CC(C)(C)C(=O)C1C2C(C3N1N=CC=C3)C(=O)N(C2=O)C4=CC=C(C=C4)F
Fc1ccc(cc1)N1C(=O)(C@H)2(C@@H)(C1=O)(C@H)(N1(C@@H)2C=CC=N1)C(=O)C(C)(C)C
InChI=1SC20H20FN3O3c120(23)17(25)161514(1354102224(13)16)18(26)23(19(15)27)128611(21)7912h4101316H13H3t13141516+m1s1
MFCD18243101
ZINC000100892539
ZINC05120082
ZINC100892539
Check stock
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Check stock on Vitas-MAvailable files
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