Vitas-M small molecule compound

methyl N-[(2S)-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-2-phenylacetyl]-L-isoleucinate

Catalog ID
STL466080
SMILES CC[C@H]([C@@H](C(=O)OC)NC(=O)[C@@H](N1Cc2c(C1=O)cccc2)c1ccccc1)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 C23H26N2O4 MW 394.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N2O4/c1-4-15(2)19(23(28)29-3)24-21(26)20(16-10-6-5-7-11-16)25-14-17-12-8-9-13-18(17)22(25)27/h5-13,15,19-20H,4,14H2,1-3H3,(H,24,26)/t15-,19+,20+/m1/s1
InChIKey
RCZRNABNLFAACC-XPGWFJOJSA-N
Synonyms

(2R3R)methyl3methyl2((S)2(1oxoisoindolin2yl)2phenylacetamido)pentanoate
CC(C@H)((C@@H)(C(=O)OC)NC(=O)(C@@H)(N1Cc2c(C1=O)cccc2)c1ccccc1)C
CC(C@H)((C@H)(C(=O)OC)NC(=O)(C@@H)(N1Cc2c(C1=O)cccc2)c1ccccc1)C
CCC(C)C(C(=O)OC)NC(=O)C(C1=CC=CC=C1)N2CC3=CC=CC=C3C2=O
InChI=1SC23H26N2O4c1415(2)19(23(28)293)2421(26)20(16106571116)25141712891318(17)22(25)27h513151920H414H213H3(H2426)t1519+20+m1s1
methyl(2S3R)3methyl2(((2S)2(3oxo1Hisoindol2yl)2phenylacetyl)amino)pentanoate
methylN((2S)2(1oxo13dihydro2Hisoindol2yl)2phenylacetyl)Lisoleucinate
ZINC000030819466
ZINC30819466

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Available files

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