Vitas-M small molecule compound
N-(5-chloro-2-methoxyphenyl)-10-(4-methoxybenzyl)-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
STL347729
SMILES COc1ccc(cc1)CN1C(=O)C2C(C1=O)C1N(C2C(=O)Nc2cc(Cl)ccc2OC)C=Cc2c1cccc2
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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 C30H26ClN3O5 MW 544.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H26ClN3O5/c1-38-20-10-7-17(8-11-20)16-34-29(36)24-25(30(34)37)27(28(35)32-22-15-19(31)9-12-23(22)39-2)33-14-13-18-5-3-4-6-21(18)26(24)33/h3-15,24-27H,16H2,1-2H3,(H,32,35)InChIKey
KFBOGCQHWYTUFR-UHFFFAOYSA-NSynonyms
(8S8aR11aS)N(5chloro2methoxyphenyl)10(4methoxybenzyl)911dioxo8a9101111a11bhexahydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline8carboxamide
COC1=CC=C(C=C1)CN2C(=O)C3C(C2=O)C(N4C3C5=CC=CC=C5C=C4)C(=O)NC6=C(C=CC(=C6)Cl)OC
COc1ccc(cc1)CN1C(=O)(C@@H)2(C@H)(C1=O)C1N((C@@H)2C(=O)Nc2cc(Cl)ccc2OC)C=Cc2c1cccc2
InChI=1SC30H26ClN3O5c1382010717(81120)163429(36)2425(30(34)37)27(28(35)32221519(31)91223(22)392)33141318534621(18)26(24)33h3152427H16H212H3(H3235)
MFCD28032524
N(5chloro2methoxyphenyl)10(4methoxybenzyl)911dioxo8a9101111a11bhexahydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline8carboxamide
ZINC000101197225
ZINC000245310729
Check stock
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Check stock on Vitas-MAvailable files
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