Vitas-M small molecule compound
tert-butyl (3S)-3-({(2S)-1-[(4-methoxybenzyl)amino]-1-oxopropan-2-yl}carbamoyl)-3,4-dihydroisoquinoline-2(1H)-carboxylate
Catalog ID
STK591246
SMILES COc1ccc(cc1)CNC(=O)[C@@H](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 C26H33N3O5 MW 467.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H33N3O5/c1-17(23(30)27-15-18-10-12-21(33-5)13-11-18)28-24(31)22-14-19-8-6-7-9-20(19)16-29(22)25(32)34-26(2,3)4/h6-13,17,22H,14-16H2,1-5H3,(H,27,30)(H,28,31)/t17-,22-/m0/s1InChIKey
HJVVTSIHVIVQBI-JTSKRJEESA-NSynonyms
1014084-17-3(S)tertbutyl3(((S)1((4methoxybenzyl)amino)1oxopropan2yl)carbamoyl)34dihydroisoquinoline2(1H)carboxylate
1014084173
CC(C(=O)NCC1=CC=C(C=C1)OC)NC(=O)C2CC3=CC=CC=C3CN2C(=O)OC(C)(C)C
COc1ccc(cc1)CNC(=O)(C@@H)(NC(=O)(C@@H)1Cc2ccccc2CN1C(=O)OC(C)(C)C)C
InChI=1SC26H33N3O5c117(23(30)271518101221(335)131118)2824(31)221419867920(19)1629(22)25(32)3426(23)4h6131722H1416H215H3(H2730)(H2831)t1722m0s1
MFCD07639414
tertbutyl(3S)3(((2S)1((4methoxybenzyl)amino)1oxopropan2yl)carbamoyl)34dihydroisoquinoline2(1H)carboxylate
tertbutyl(3S)3(((2S)1((4methoxyphenyl)methylamino)1oxopropan2yl)carbamoyl)34dihydro1Hisoquinoline2carboxylate
ZINC000009128915
ZINC09128915
ZINC9128915
Check stock
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Check stock on Vitas-MAvailable files
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