Vitas-M small molecule compound
tert-butyl (3S)-3-{[(2S)-1-(cyclohexylamino)-1-oxopropan-2-yl]carbamoyl}-3,4-dihydroisoquinoline-2(1H)-carboxylate
Catalog ID
STK571805
SMILES O=C([C@@H](NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C)C)NC1CCCCC1
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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 C24H35N3O4 MW 429.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H35N3O4/c1-16(21(28)26-19-12-6-5-7-13-19)25-22(29)20-14-17-10-8-9-11-18(17)15-27(20)23(30)31-24(2,3)4/h8-11,16,19-20H,5-7,12-15H2,1-4H3,(H,25,29)(H,26,28)/t16-,20-/m0/s1InChIKey
JSABPCRZHWHVLJ-JXFKEZNVSA-NSynonyms
1173679-50-9(S)tertbutyl3(((R)1(cyclohexylamino)1oxopropan2yl)carbamoyl)34dihydroisoquinoline2(1H)carboxylate
1173679509
CC(C(=O)NC1CCCCC1)NC(=O)C2CC3=CC=CC=C3CN2C(=O)OC(C)(C)C
InChI=1SC24H35N3O4c116(21(28)2619126571319)2522(29)20141710891118(17)1527(20)23(30)3124(23)4h811161920H571215H214H3(H2529)(H2628)t1620m0s1
MFCD06778029
O=C((C@@H)(NC(=O)(C@@H)1Cc2ccccc2CN1C(=O)OC(C)(C)C)C)NC1CCCCC1
O=C((C@H)(NC(=O)(C@@H)1Cc2ccccc2CN1C(=O)OC(C)(C)C)C)NC1CCCCC1
TERTBUTYL(3S)3(((2S)1(CYCLOHEXYLAMINO)1OXOPROPAN2YL)CARBAMOYL)34DIHYDRO1HISOQUINOLINE2CARBOXYLATE
tertbutyl(3S)3(((2S)1(cyclohexylamino)1oxopropan2yl)carbamoyl)34dihydroisoquinoline2(1H)carboxylate
ZINC000005271911
ZINC05271911
ZINC5271911
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.