Vitas-M small molecule compound
(4bR,7aS,8R)-6-(2-methyl-4-nitrophenyl)-8-(phenylcarbonyl)-7a,8-dihydro-4aH-pyrrolo[3',4':3,4]pyrrolo[1,2-b]pyridazine-5,7(4bH,6H)-dione
Catalog ID
STK551026
SMILES O=C1[C@H]2[C@@H](C(=O)N1c1ccc(cc1C)[N+](=O)[O-])C1N([C@H]2C(=O)c2ccccc2)N=CC=C1
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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 C23H18N4O5 MW 430.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18N4O5/c1-13-12-15(27(31)32)9-10-16(13)25-22(29)18-17-8-5-11-24-26(17)20(19(18)23(25)30)21(28)14-6-3-2-4-7-14/h2-12,17-20H,1H3/t17?,18-,19-,20+/m0/s1InChIKey
DIKMEPIJUPGTNE-SEBOWIOWSA-NSynonyms
1014082-95-1(3aS4R9bR)4benzoyl2(2methyl4nitrophenyl)3a49a9btetrahydropyrrolo(12)pyrrolo(35b)pyridazine13dione
(4bR7aS8R)6(2methyl4nitrophenyl)8(phenylcarbonyl)7a8dihydro4aHpyrrolo(3434)pyrrolo(12b)pyridazine57(4bH6H)dione
(4bR7aS8R)8benzoyl6(2methyl4nitrophenyl)7a8dihydro4aHpyrrolo(3434)pyrrolo(12b)pyridazine57(4bH6H)dione
1014082951
CC1=C(C=CC(=C1)(N+)(=O)(O))N2C(=O)C3C4C=CC=NN4C(C3C2=O)C(=O)C5=CC=CC=C5
InChI=1SC23H18N4O5c1131215(27(31)32)91016(13)2522(29)181785112426(17)20(19(18)23(25)30)21(28)146324714h2121720H1H3t17?181920+m0s1
MFCD18242556
O=C1(C@H)2(C@@H)(C(=O)N1c1ccc(cc1C)(N+)(=O)(O))C1N((C@H)2C(=O)c2ccccc2)N=CC=C1
ZINC000017838108
ZINC000018028765
Check stock
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Check stock on Vitas-MAvailable files
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