Vitas-M small molecule compound

3-[4-methyl-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)pentanoyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one

Catalog ID
STL496490
SMILES CC(CC(N1Cc2c(C1=O)cccc2)C(=O)N1CC2CC(C1)c1n(C2)c(=O)ccc1)C

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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 C25H29N3O3 MW 419.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N3O3/c1-16(2)10-22(28-15-18-6-3-4-7-20(18)24(28)30)25(31)26-12-17-11-19(14-26)21-8-5-9-23(29)27(21)13-17/h3-9,16-17,19,22H,10-15H2,1-2H3
InChIKey
YRVWEQQORGEBHY-UHFFFAOYSA-N
Synonyms

(1R5S)3((S)4methyl2(1oxoisoindolin2yl)pentanoyl)3456tetrahydro1H15methanopyrido(12a)(15)diazocin8(2H)one
3(4methyl2(1oxo13dihydro2Hisoindol2yl)pentanoyl)123456hexahydro8H15methanopyrido(12a)(15)diazocin8one
CC(C(C@H)(N1Cc2c(C1=O)cccc2)C(=O)N1C(C@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1)C
MFCD31751443
ZINC000225417260
ZINC000504604155

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Available files

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