Vitas-M small molecule compound
(4aR,4bS,7aR,8S)-8-[(3,4-dimethoxyphenyl)carbonyl]-6-(2-methoxyphenyl)-7a,8-dihydro-4aH-pyrrolo[3',4':3,4]pyrrolo[1,2-b]pyridazine-5,7(4bH,6H)-dione
Catalog ID
STK554782
SMILES COc1cc(ccc1OC)C(=O)[C@H]1N2N=CC=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1OC
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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 C25H23N3O6 MW 461.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N3O6/c1-32-17-9-5-4-7-15(17)27-24(30)20-16-8-6-12-26-28(16)22(21(20)25(27)31)23(29)14-10-11-18(33-2)19(13-14)34-3/h4-13,16,20-22H,1-3H3/t16-,20-,21-,22+/m1/s1InChIKey
BGXWMQNBPQJOKP-DHWLSRIRSA-NSynonyms
1013751-38-6(3aR4S9aR9bS)4(34dimethoxybenzoyl)2(2methoxyphenyl)3a49a9btetrahydropyrrolo(12)pyrrolo(35b)pyridazine13dione
(4aR4bS7aR8S)8((34dimethoxyphenyl)carbonyl)6(2methoxyphenyl)7a8dihydro4aHpyrrolo(3434)pyrrolo(12b)pyridazine57(4bH6H)dione
(4aR4bS7aR8S)8(34dimethoxybenzoyl)6(2methoxyphenyl)7a8dihydro4aHpyrrolo(3434)pyrrolo(12b)pyridazine57(4bH6H)dione
1013751386
COC1=C(C=C(C=C1)C(=O)C2C3C(C4N2N=CC=C4)C(=O)N(C3=O)C5=CC=CC=C5OC)OC
COc1cc(ccc1OC)C(=O)(C@H)1N2N=CC=C(C@@H)2(C@@H)2(C@H)1C(=O)N(C2=O)c1ccccc1OC
InChI=1SC25H23N3O6c13217954715(17)2724(30)201686122628(16)22(21(20)25(27)31)23(29)14101118(332)19(1314)343h413162022H13H3t16202122+m1s1
MFCD18242826
ZINC000009165098
ZINC09165098
ZINC9165098
Check stock
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Check stock on Vitas-MAvailable files
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