Vitas-M small molecule compound
6,7-dimethoxy-N-((2S,3R)-1-((4-methoxyphenyl)amino)-3-methyl-1-oxopentan-2-yl)-3,4-dihydroisoquinoline-2(1H)-carboxamide
Catalog ID
STL535060
SMILES COc1ccc(cc1)NC(=O)[C@H](C(CC)C)NC(=O)N1CCc2c(C1)cc(c(c2)OC)OC
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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 C25H33N3O5 MW 455.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H33N3O5/c1-6-16(2)23(24(29)26-19-7-9-20(31-3)10-8-19)27-25(30)28-12-11-17-13-21(32-4)22(33-5)14-18(17)15-28/h7-10,13-14,16,23H,6,11-12,15H2,1-5H3,(H,26,29)(H,27,30)/t16?,23-/m0/s1InChIKey
GHYRMCXNXNFNSZ-KESSSICBSA-NSynonyms
956921-78-116408502
67dimethoxy~(N)((2~(S))1(4methoxyanilino)3methyl1oxopentan2yl)34dihydro1~(H)isoquinoline2carboxamide
67dimethoxyN((2S3R)1((4methoxyphenyl)amino)3methyl1oxopentan2yl)34dihydroisoquinoline2(1H)carboxamide
956921781
COc1ccc(cc1)NC(=O)(C@H)(C(CC)C)NC(=O)N1CCc2c(C1)cc(c(c2)OC)OC
InChI=1SC25H33N3O5c1616(2)23(24(29)26197920(313)10819)2725(30)281211171321(324)22(335)1418(17)1528h71013141623H6111215H215H3(H2629)(H2730)t16?23m0s1
ZINC000008764285
ZINC000012896897
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