Vitas-M small molecule compound
(4aR,4bS,7aR,8S)-N-(4-chlorophenyl)-6-(4-methoxyphenyl)-5,7-dioxo-4b,5,6,7,7a,8-hexahydro-4aH-pyrrolo[3',4':3,4]pyrrolo[1,2-b]pyridazine-8-carboxamide
Catalog ID
STK554007
SMILES COc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H]1N([C@@H]2C(=O)Nc2ccc(cc2)Cl)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 C23H19ClN4O4 MW 450.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19ClN4O4/c1-32-16-10-8-15(9-11-16)27-22(30)18-17-3-2-12-25-28(17)20(19(18)23(27)31)21(29)26-14-6-4-13(24)5-7-14/h2-12,17-20H,1H3,(H,26,29)/t17-,18-,19-,20+/m1/s1InChIKey
OQDGDKSTOIYUHR-WTGUMLROSA-NSynonyms
958988-95-9(3aR4S9aR9bS)N(4chlorophenyl)2(4methoxyphenyl)13dioxo3a49a9btetrahydropyrrolo(12)pyrrolo(35b)pyridazine4carboxamide
(4aR4bS7aR8S)N(4chlorophenyl)6(4methoxyphenyl)57dioxo4b5677a8hexahydro4aHpyrrolo(3434)pyrrolo(12b)pyridazine8carboxamide
958988959
COC1=CC=C(C=C1)N2C(=O)C3C4C=CC=NN4C(C3C2=O)C(=O)NC5=CC=C(C=C5)Cl
COc1ccc(cc1)N1C(=O)(C@@H)2(C@H)(C1=O)(C@@H)1N((C@@H)2C(=O)Nc2ccc(cc2)Cl)N=CC=C1
InChI=1SC23H19ClN4O4c1321610815(91116)2722(30)181732122528(17)20(19(18)23(27)31)21(29)26146413(24)5714h2121720H1H3(H2629)t17181920+m1s1
MFCD18242764
ZINC000013635954
ZINC13635954
Check stock
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