Vitas-M small molecule compound
10-benzyl-N-(5-chloro-2-methoxyphenyl)-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
STL347408
SMILES COc1ccc(cc1NC(=O)C1C2C(=O)N(C(=O)C2C2N1C=Cc1c2cccc1)Cc1ccccc1)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 C29H24ClN3O4 MW 513.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24ClN3O4/c1-37-22-12-11-19(30)15-21(22)31-27(34)26-24-23(25-20-10-6-5-9-18(20)13-14-32(25)26)28(35)33(29(24)36)16-17-7-3-2-4-8-17/h2-15,23-26H,16H2,1H3,(H,31,34)InChIKey
RLQHABLVGWKXFM-UHFFFAOYSA-NSynonyms
(8S8aR11aS)10benzylN(5chloro2methoxyphenyl)911dioxo8a9101111a11bhexahydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline8carboxamide
10benzylN(5chloro2methoxyphenyl)911dioxo8a9101111a11bhexahydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline8carboxamide
COC1=C(C=C(C=C1)Cl)NC(=O)C2C3C(C4N2C=CC5=CC=CC=C45)C(=O)N(C3=O)CC6=CC=CC=C6
COc1ccc(cc1NC(=O)(C@@H)1(C@@H)2C(=O)N(C(=O)(C@@H)2C2N1C=Cc1c2cccc1)Cc1ccccc1)Cl
InChI=1SC29H24ClN3O4c13722121119(30)1521(22)3127(34)262423(25201065918(20)131432(25)26)28(35)33(29(24)36)16177324817h2152326H16H21H3(H3134)
MFCD28032258
ZINC000016000717
ZINC000245311991
Check stock
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Check stock on Vitas-MAvailable files
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