Vitas-M small molecule compound
10-(4-methylphenyl)-9,11-dioxo-N-phenyl-8a,9,10,11,11a,11b-hexahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-8-carboxamide
Catalog ID
STL240753
SMILES Cc1ccc(cc1)N1C(=O)C2C(C1=O)C1N(C2C(=O)Nc2ccccc2)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 C27H22N4O3 MW 450.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N4O3/c1-16-11-13-19(14-12-16)30-26(33)21-22(27(30)34)24(25(32)29-18-8-3-2-4-9-18)31-23(21)20-10-6-5-7-17(20)15-28-31/h2-15,21-24H,1H3,(H,29,32)InChIKey
DPOATQXCXXGBFZ-UHFFFAOYSA-NSynonyms
(8R8aS11aR)911dioxoNphenyl10(ptolyl)8a9101111a11bhexahydro8Hpyrrolo(3434)pyrrolo(21a)phthalazine8carboxamide
10(4methylphenyl)911dioxoNphenyl8a9101111a11bhexahydro8Hpyrrolo(3434)pyrrolo(21a)phthalazine8carboxamide
CC1=CC=C(C=C1)N2C(=O)C3C(C2=O)C(N4C3C5=CC=CC=C5C=N4)C(=O)NC6=CC=CC=C6
Cc1ccc(cc1)N1C(=O)(C@H)2(C@@H)(C1=O)C1N((C@H)2C(=O)Nc2ccccc2)N=Cc2c1cccc2
InChI=1SC27H22N4O3c116111319(141216)3026(33)2122(27(30)34)24(25(32)29188324918)3123(21)201065717(20)152831h2152124H1H3(H2932)
MFCD24859033
ZINC000101342830
ZINC000248083547
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