Vitas-M small molecule compound
tert-butyl (3S)-3-{[(2S)-1-(cyclohexylamino)-3-methyl-1-oxobutan-2-yl]carbamoyl}-3,4-dihydroisoquinoline-2(1H)-carboxylate
Catalog ID
STK575062
SMILES CC([C@@H](C(=O)NC1CCCCC1)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 C26H39N3O4 MW 457.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H39N3O4/c1-17(2)22(24(31)27-20-13-7-6-8-14-20)28-23(30)21-15-18-11-9-10-12-19(18)16-29(21)25(32)33-26(3,4)5/h9-12,17,20-22H,6-8,13-16H2,1-5H3,(H,27,31)(H,28,30)/t21-,22-/m0/s1InChIKey
SCHQYZZHYUGFTN-VXKWHMMOSA-NSynonyms
1014022-22-0(S)tertbutyl3(((S)1(cyclohexylamino)3methyl1oxobutan2yl)carbamoyl)34dihydroisoquinoline2(1H)carboxylate
1014022220
CC((C@@H)(C(=O)NC1CCCCC1)NC(=O)(C@@H)1Cc2ccccc2CN1C(=O)OC(C)(C)C)C
CC(C)C(C(=O)NC1CCCCC1)NC(=O)C2CC3=CC=CC=C3CN2C(=O)OC(C)(C)C
InChI=1SC26H39N3O4c117(2)22(24(31)2720137681420)2823(30)211518119101219(18)1629(21)25(32)3326(34)5h912172022H681316H215H3(H2731)(H2830)t2122m0s1
MFCD07638979
tertbutyl(3S)3(((2S)1(cyclohexylamino)3methyl1oxobutan2yl)carbamoyl)34dihydro1Hisoquinoline2carboxylate
tertbutyl(3S)3(((2S)1(cyclohexylamino)3methyl1oxobutan2yl)carbamoyl)34dihydroisoquinoline2(1H)carboxylate
ZINC000009128631
ZINC09128631
ZINC9128631
Check stock
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Check stock on Vitas-MAvailable files
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