Vitas-M small molecule compound
(4aR,4bS,7aR,8S)-N-(4-chlorophenyl)-6-(2,4-dichlorophenyl)-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
STK554715
SMILES Clc1ccc(cc1)NC(=O)[C@H]1N2N=CC=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1Cl)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 C22H15Cl3N4O3 MW 489.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15Cl3N4O3/c23-11-3-6-13(7-4-11)27-20(30)19-18-17(16-2-1-9-26-29(16)19)21(31)28(22(18)32)15-8-5-12(24)10-14(15)25/h1-10,16-19H,(H,27,30)/t16-,17-,18-,19+/m1/s1InChIKey
VJHOKVMYCNDOMR-MKXGPGLRSA-NSynonyms
958986-59-9(3aR4S9aR9bS)N(4chlorophenyl)2(24dichlorophenyl)13dioxo3a49a9btetrahydropyrrolo(12)pyrrolo(35b)pyridazine4carboxamide
(4aR4bS7aR8S)N(4chlorophenyl)6(24dichlorophenyl)57dioxo4b5677a8hexahydro4aHpyrrolo(3434)pyrrolo(12b)pyridazine8carboxamide
958986599
C1=CC2C3C(C(N2N=C1)C(=O)NC4=CC=C(C=C4)Cl)C(=O)N(C3=O)C5=C(C=C(C=C5)Cl)Cl
Clc1ccc(cc1)NC(=O)(C@H)1N2N=CC=C(C@@H)2(C@@H)2(C@H)1C(=O)N(C2=O)c1ccc(cc1Cl)Cl
InChI=1SC22H15Cl3N4O3c23113613(7411)2720(30)191817(162192629(16)19)21(31)28(22(18)32)158512(24)1014(15)25h1101619H(H2730)t16171819+m1s1
MFCD18242821
ZINC000009331352
ZINC09331352
ZINC9331352
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.