Vitas-M small molecule compound
(8S,8aR,11aS,11bS)-10-(4-chlorophenyl)-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
STK543837
SMILES NC(=O)[C@@H]1[C@@H]2C(=O)N(C(=O)[C@@H]2[C@@H]2N1C=Cc1c2cccc1)c1ccc(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 C21H16ClN3O3 MW 393.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16ClN3O3/c22-12-5-7-13(8-6-12)25-20(27)15-16(21(25)28)18(19(23)26)24-10-9-11-3-1-2-4-14(11)17(15)24/h1-10,15-18H,(H2,23,26)/t15-,16+,17+,18-/m0/s1InChIKey
ACLHURZOHSRIQP-MLHJIOFPSA-NSynonyms
956186-78-0(8S8aR11aS11bS)10(4chlorophenyl)911dioxo8a9101111a11bhexahydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline8carboxamide
956186780
C1=CC=C2C3C4C(C(N3C=CC2=C1)C(=O)N)C(=O)N(C4=O)C5=CC=C(C=C5)Cl
InChI=1SC21H16ClN3O3c22125713(8612)2520(27)1516(21(25)28)18(19(23)26)2410911312414(11)17(15)24h1101518H(H22326)t1516+17+18m0s1
MFCD18242105
NC(=O)(C@@H)1(C@@H)2C(=O)N(C(=O)(C@@H)2(C@@H)2N1C=Cc1c2cccc1)c1ccc(cc1)Cl
ZINC000016037148
ZINC16037148
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