Vitas-M small molecule compound
tert-butyl (3S)-3-({2-[(2-methoxy-5-methylphenyl)amino]-2-oxoethyl}carbamoyl)-3,4-dihydroisoquinoline-2(1H)-carboxylate
Catalog ID
STK583092
SMILES COc1ccc(cc1NC(=O)CNC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C)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 C25H31N3O5 MW 453.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31N3O5/c1-16-10-11-21(32-5)19(12-16)27-22(29)14-26-23(30)20-13-17-8-6-7-9-18(17)15-28(20)24(31)33-25(2,3)4/h6-12,20H,13-15H2,1-5H3,(H,26,30)(H,27,29)/t20-/m0/s1InChIKey
WADJLKARZFTMFN-FQEVSTJZSA-NSynonyms
1013983-28-2(S)tertbutyl3((2((2methoxy5methylphenyl)amino)2oxoethyl)carbamoyl)34dihydroisoquinoline2(1H)carboxylate
1013983282
CC1=CC(=C(C=C1)OC)NC(=O)CNC(=O)C2CC3=CC=CC=C3CN2C(=O)OC(C)(C)C
COc1ccc(cc1NC(=O)CNC(=O)(C@@H)1Cc2ccccc2CN1C(=O)OC(C)(C)C)C
InChI=1SC25H31N3O5c116101121(325)19(1216)2722(29)142623(30)201317867918(17)1528(20)24(31)3325(23)4h61220H1315H215H3(H2630)(H2729)t20m0s1
MFCD06771249
tertbutyl(3S)3((2((2methoxy5methylphenyl)amino)2oxoethyl)carbamoyl)34dihydroisoquinoline2(1H)carboxylate
tertbutyl(3S)3((2(2methoxy5methylanilino)2oxoethyl)carbamoyl)34dihydro1Hisoquinoline2carboxylate
ZINC000013554451
ZINC13554451
Check stock
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