Vitas-M small molecule compound
(8S,8aR,11aS)-10-(4-acetylphenyl)-8-[(4-chlorophenyl)carbonyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-9,11(8aH,10H)-dione
Catalog ID
STK548118
SMILES Clc1ccc(cc1)C(=O)[C@@H]1[C@@H]2C(=O)N(C(=O)[C@@H]2C2N1N=Cc1c2cccc1)c1ccc(cc1)C(=O)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 C28H20ClN3O4 MW 497.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H20ClN3O4/c1-15(33)16-8-12-20(13-9-16)31-27(35)22-23(28(31)36)25(26(34)17-6-10-19(29)11-7-17)32-24(22)21-5-3-2-4-18(21)14-30-32/h2-14,22-25H,1H3/t22-,23+,24?,25-/m0/s1InChIKey
JEGTUJBVFWWZPX-NPZNXQLHSA-NSynonyms
1013747-74-4(8S8aR11aS)10(4acetylphenyl)8((4chlorophenyl)carbonyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)phthalazine911(8aH10H)dione
(8S8aR11aS)10(4acetylphenyl)8(4chlorobenzoyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)phthalazine911(8aH10H)dione
1013747744
CC(=O)C1=CC=C(C=C1)N2C(=O)C3C(C2=O)C(N4C3C5=CC=CC=C5C=N4)C(=O)C6=CC=C(C=C6)Cl
Clc1ccc(cc1)C(=O)(C@@H)1(C@@H)2C(=O)N(C(=O)(C@@H)2C2N1N=Cc1c2cccc1)c1ccc(cc1)C(=O)C
InChI=1SC28H20ClN3O4c115(33)1681220(13916)3127(35)2223(28(31)36)25(26(34)1761019(29)11717)3224(22)21532418(21)143032h2142225H1H3t2223+24?25m0s1
MFCD18242401
ZINC000009427553
ZINC000018069042
Check stock
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Check stock on Vitas-MAvailable files
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