Vitas-M small molecule compound
2-(3,4-dihydroisoquinolin-2(1H)-ylmethyl)-4-[(3-methoxyphenyl)amino]-4-oxobutanoic acid
Catalog ID
STL154848
SMILES COc1cccc(c1)NC(=O)CC(C(=O)O)CN1CCc2c(C1)cccc2
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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 C21H24N2O4 MW 368.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O4/c1-27-19-8-4-7-18(12-19)22-20(24)11-17(21(25)26)14-23-10-9-15-5-2-3-6-16(15)13-23/h2-8,12,17H,9-11,13-14H2,1H3,(H,22,24)(H,25,26)InChIKey
XOVCCVQWAOHQST-UHFFFAOYSA-NSynonyms
1324085-88-21324085882
2((34dihydroisoquinolin2(1H)yl)methyl)4((3methoxyphenyl)amino)4oxobutanoicacid
2(34dihydro1Hisoquinolin2ylmethyl)4(3methoxyanilino)4oxobutanoicacid
2(34dihydroisoquinolin2(1H)ylmethyl)4((3methoxyphenyl)amino)4oxobutanoicacid
COC1=CC=CC(=C1)NC(=O)CC(CN2CCC3=CC=CC=C3C2)C(=O)O
InChI=1SC21H24N2O4c1271984718(1219)2220(24)1117(21(25)26)142310915523616(15)1323h281217H9111314H21H3(H2224)(H2526)
MFCD19708266
ZINC000071279443
ZINC000071279444
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