Vitas-M small molecule compound
(4aR,4bS,7aR,8S)-6-(3-bromophenyl)-N-(4-chlorophenyl)-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
STK553643
SMILES O=C([C@H]1N2N=CC=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1cccc(c1)Br)Nc1ccc(cc1)Cl
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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 C22H16BrClN4O3 MW 499.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16BrClN4O3/c23-12-3-1-4-15(11-12)27-21(30)17-16-5-2-10-25-28(16)19(18(17)22(27)31)20(29)26-14-8-6-13(24)7-9-14/h1-11,16-19H,(H,26,29)/t16-,17-,18-,19+/m1/s1InChIKey
JDWKUBREXBGTSR-MKXGPGLRSA-NSynonyms
1212447-50-1(3aR4S9aR9bS)2(3bromophenyl)N(4chlorophenyl)13dioxo3a49a9btetrahydropyrrolo(12)pyrrolo(35b)pyridazine4carboxamide
(4aR4bS7aR8S)6(3bromophenyl)N(4chlorophenyl)57dioxo4b5677a8hexahydro4aHpyrrolo(3434)pyrrolo(12b)pyridazine8carboxamide
1212447501
C1=CC2C3C(C(N2N=C1)C(=O)NC4=CC=C(C=C4)Cl)C(=O)N(C3=O)C5=CC(=CC=C5)Br
InChI=1SC22H16BrClN4O3c231231415(1112)2721(30)171652102528(16)19(18(17)22(27)31)20(29)26148613(24)7914h1111619H(H2629)t16171819+m1s1
MFCD18242733
O=C((C@H)1N2N=CC=C(C@@H)2(C@@H)2(C@H)1C(=O)N(C2=O)c1cccc(c1)Br)Nc1ccc(cc1)Cl
ZINC000009461506
ZINC09461506
ZINC9461506
Check stock
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