Vitas-M small molecule compound
(8S,8aR,11aS,11bS)-10-(4-methylphenyl)-8-(phenylcarbonyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-9,11(8aH,10H)-dione
Catalog ID
STK613538
SMILES Cc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H]1N([C@@H]2C(=O)c2ccccc2)N=Cc2c1cccc2
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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 C27H21N3O3 MW 435.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21N3O3/c1-16-11-13-19(14-12-16)29-26(32)21-22(27(29)33)24(25(31)17-7-3-2-4-8-17)30-23(21)20-10-6-5-9-18(20)15-28-30/h2-15,21-24H,1H3/t21-,22+,23+,24-/m0/s1InChIKey
BNCRVEMSACYJEW-KEZOAJOQSA-NSynonyms
956157-39-4(8S8aR11aS11bS)10(4methylphenyl)8(phenylcarbonyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)phthalazine911(8aH10H)dione
(8S8aR11aS11bS)8benzoyl10(ptolyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)phthalazine911(8aH10H)dione
956157394
CC1=CC=C(C=C1)N2C(=O)C3C(C2=O)C(N4C3C5=CC=CC=C5C=N4)C(=O)C6=CC=CC=C6
Cc1ccc(cc1)N1C(=O)(C@@H)2(C@H)(C1=O)(C@@H)1N((C@@H)2C(=O)c2ccccc2)N=Cc2c1cccc2
InChI=1SC27H21N3O3c116111319(141216)2926(32)2122(27(29)33)24(25(31)177324817)3023(21)201065918(20)152830h2152124H1H3t2122+23+24m0s1
MFCD18246293
ZINC000018033997
ZINC18033997
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