Vitas-M small molecule compound
(8R,8aS,11aR)-8-acetyl-10-(4-methylphenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-9,11(8aH,10H)-dione
Catalog ID
STK549524
SMILES CC(=O)[C@H]1[C@H]2C(=O)N(C(=O)[C@H]2C2N1N=Cc1c2cccc1)c1ccc(cc1)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 C22H19N3O3 MW 373.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N3O3/c1-12-7-9-15(10-8-12)24-21(27)17-18(22(24)28)20-16-6-4-3-5-14(16)11-23-25(20)19(17)13(2)26/h3-11,17-20H,1-2H3/t17-,18+,19-,20?/m0/s1InChIKey
SVODXASRTNDFIO-COHPWVSRSA-NSynonyms
1212466-75-5(8R8aS11aR)8acetyl10(4methylphenyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)phthalazine911(8aH10H)dione
(8R8aS11aR)8acetyl10(ptolyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)phthalazine911(8aH10H)dione
1212466755
CC(=O)(C@H)1(C@H)2C(=O)N(C(=O)(C@H)2C2N1N=Cc1c2cccc1)c1ccc(cc1)C
CC1=CC=C(C=C1)N2C(=O)C3C(C2=O)C(N4C3C5=CC=CC=C5C=N4)C(=O)C
InChI=1SC22H19N3O3c1127915(10812)2421(27)1718(22(24)28)2016643514(16)112325(20)19(17)13(2)26h3111720H12H3t1718+1920?m0s1
MFCD18242470
ZINC000005053861
ZINC000016038802
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