Vitas-M small molecule compound
(8R,8aS,11aR)-N-(4-chlorophenyl)-10-(2,4-dimethylphenyl)-9,11-dioxo-8a,9,10,11,11a,11b-hexahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-8-carboxamide
Catalog ID
STK548955
SMILES Clc1ccc(cc1)NC(=O)[C@@H]1N2N=Cc3c(C2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(cc1C)C)cccc3
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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 C28H23ClN4O3 MW 498.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23ClN4O3/c1-15-7-12-21(16(2)13-15)32-27(35)22-23(28(32)36)25(26(34)31-19-10-8-18(29)9-11-19)33-24(22)20-6-4-3-5-17(20)14-30-33/h3-14,22-25H,1-2H3,(H,31,34)/t22-,23+,24?,25-/m1/s1InChIKey
GRWNEPCWOQKFMU-DVMHTGGUSA-NSynonyms
1014100-97-0(8R8aS11aR)N(4chlorophenyl)10(24dimethylphenyl)911dioxo8a9101111a11bhexahydro8Hpyrrolo(3434)pyrrolo(21a)phthalazine8carboxamide
1014100970
CC1=CC(=C(C=C1)N2C(=O)C3C(C2=O)C(N4C3C5=CC=CC=C5C=N4)C(=O)NC6=CC=C(C=C6)Cl)C
Clc1ccc(cc1)NC(=O)(C@@H)1N2N=Cc3c(C2(C@H)2(C@@H)1C(=O)N(C2=O)c1ccc(cc1C)C)cccc3
InChI=1SC28H23ClN4O3c11571221(16(2)1315)3227(35)2223(28(32)36)25(26(34)311910818(29)91119)3324(22)20643517(20)143033h3142225H12H3(H3134)t2223+24?25m1s1
MFCD18242448
ZINC000009122237
ZINC000009122238
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