Vitas-M small molecule compound
tert-butyl (3S)-3-({(2S)-3-methyl-1-oxo-1-[(1-phenylethyl)amino]butan-2-yl}carbamoyl)-3,4-dihydroisoquinoline-2(1H)-carboxylate
Catalog ID
STK584553
SMILES CC([C@@H](C(=O)NC(c1ccccc1)C)NC(=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 C28H37N3O4 MW 479.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H37N3O4/c1-18(2)24(26(33)29-19(3)20-12-8-7-9-13-20)30-25(32)23-16-21-14-10-11-15-22(21)17-31(23)27(34)35-28(4,5)6/h7-15,18-19,23-24H,16-17H2,1-6H3,(H,29,33)(H,30,32)/t19?,23-,24-/m0/s1InChIKey
BQHMANASDFKWNM-SXZQLXHWSA-NSynonyms
1014022-36-6(3S)tertbutyl3(((2S)3methyl1oxo1((1phenylethyl)amino)butan2yl)carbamoyl)34dihydroisoquinoline2(1H)carboxylate
1014022366
CC((C@@H)(C(=O)NC(c1ccccc1)C)NC(=O)(C@@H)1Cc2ccccc2CN1C(=O)OC(C)(C)C)C
CC(C)C(C(=O)NC(C)C1=CC=CC=C1)NC(=O)C2CC3=CC=CC=C3CN2C(=O)OC(C)(C)C
InChI=1SC28H37N3O4c118(2)24(26(33)2919(3)20128791320)3025(32)2316211410111522(21)1731(23)27(34)3528(45)6h71518192324H1617H216H3(H2933)(H3032)t19?2324m0s1
MFCD07638997
tertbutyl(3S)3(((2S)3methyl1oxo1((1phenylethyl)amino)butan2yl)carbamoyl)34dihydroisoquinoline2(1H)carboxylate
tertbutyl(3S)3(((2S)3methyl1oxo1(1phenylethylamino)butan2yl)carbamoyl)34dihydro1Hisoquinoline2carboxylate
ZINC000009128649
ZINC000009128651
Check stock
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Check stock on Vitas-MAvailable files
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