Vitas-M small molecule compound
(8S,8aR,11aS,11bS)-10-(4-chlorophenyl)-8-(phenylcarbonyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-9,11(8aH,10H)-dione
Catalog ID
STK537253
SMILES Clc1ccc(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 C26H18ClN3O3 MW 455.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H18ClN3O3/c27-17-10-12-18(13-11-17)29-25(32)20-21(26(29)33)23(24(31)15-6-2-1-3-7-15)30-22(20)19-9-5-4-8-16(19)14-28-30/h1-14,20-23H/t20-,21+,22+,23-/m0/s1InChIKey
AWVLAJUMRDNXSX-AFXVXQJMSA-NSynonyms
(8S8aR11aS11bS)10(4chlorophenyl)8(phenylcarbonyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)phthalazine911(8aH10H)dione
(8S8aR11aS11bS)8benzoyl10(4chlorophenyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)phthalazine911(8aH10H)dione
C1=CC=C(C=C1)C(=O)C2C3C(C4N2N=CC5=CC=CC=C45)C(=O)N(C3=O)C6=CC=C(C=C6)Cl
Clc1ccc(cc1)N1C(=O)(C@@H)2(C@H)(C1=O)(C@@H)1N((C@@H)2C(=O)c2ccccc2)N=Cc2c1cccc2
InChI=1SC26H18ClN3O3c2717101218(131117)2925(32)2021(26(29)33)23(24(31)156213715)3022(20)19954816(19)142830h1142023Ht2021+22+23m0s1
MFCD18241680
ZINC000018205429
ZINC18205429
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