Vitas-M small molecule compound
(8S,8aR,11aS,11bS)-10-(3,5-dichlorophenyl)-9,11-dioxo-8a,9,10,11,11a,11b-hexahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-8-carboxamide
Catalog ID
STK556431
SMILES NC(=O)[C@@H]1[C@H]2[C@@H]([C@@H]3N1C=Cc1c3cccc1)C(=O)N(C2=O)c1cc(Cl)cc(c1)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 C21H15Cl2N3O3 MW 428.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15Cl2N3O3/c22-11-7-12(23)9-13(8-11)26-20(28)15-16(21(26)29)18(19(24)27)25-6-5-10-3-1-2-4-14(10)17(15)25/h1-9,15-18H,(H2,24,27)/t15-,16+,17+,18-/m0/s1InChIKey
NWANDGFJGLFONL-MLHJIOFPSA-NSynonyms
1014004-05-7(8S8aR11aS11bS)10(35dichlorophenyl)911dioxo8a9101111a11bhexahydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline8carboxamide
1014004057
C1=CC=C2C3C4C(C(N3C=CC2=C1)C(=O)N)C(=O)N(C4=O)C5=CC(=CC(=C5)Cl)Cl
InChI=1SC21H15Cl2N3O3c2211712(23)913(811)2620(28)1516(21(26)29)18(19(24)27)256510312414(10)17(15)25h191518H(H22427)t1516+17+18m0s1
MFCD18242941
NC(=O)(C@@H)1(C@H)2(C@@H)((C@@H)3N1C=Cc1c3cccc1)C(=O)N(C2=O)c1cc(Cl)cc(c1)Cl
ZINC000015974991
ZINC15974991
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