Vitas-M small molecule compound
N-[(3R)-3-(4-chlorophenyl)-4-{[(3S)-1,2,3,4-tetrahydroisoquinolin-3-ylcarbonyl]amino}butanoyl]-beta-alanine
Catalog ID
STK605989
SMILES O=C(CC(c1ccc(cc1)Cl)CNC(=O)[C@H]1NCc2c(C1)cccc2)NCCC(=O)O
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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 C23H26ClN3O4 MW 443.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26ClN3O4/c24-19-7-5-15(6-8-19)18(12-21(28)25-10-9-22(29)30)14-27-23(31)20-11-16-3-1-2-4-17(16)13-26-20/h1-8,18,20,26H,9-14H2,(H,25,28)(H,27,31)(H,29,30)/t18-,20-/m0/s1InChIKey
XRJKHYRXRGQPRE-ICSRJNTNSA-NSynonyms
3(((3R)3(4chlorophenyl)4(((3S)1234tetrahydroisoquinoline3carbonyl)amino)butanoyl)amino)propanoicacid
3((R)3(4chlorophenyl)4((S)1234tetrahydroisoquinoline3carboxamido)butanamido)propanoicacidhydrochloride
C1C(NCC2=CC=CC=C21)C(=O)NCC(CC(=O)NCCC(=O)O)C3=CC=C(C=C3)Cl
InChI=1SC23H26ClN3O4c24197515(6819)18(1221(28)2510922(29)30)142723(31)201116312417(16)132620h18182026H914H2(H2528)(H2731)(H2930)t1820m0s1
MFCD08291865
N((3R)3(4chlorophenyl)4(((3S)1234tetrahydroisoquinolin3ylcarbonyl)amino)butanoyl)betaalanine
O=C(C(C@H)(c1ccc(cc1)Cl)CNC(=O)(C@H)1NCc2c(C1)cccc2)NCCC(=O)OCl
O=C(CC(c1ccc(cc1)Cl)CNC(=O)(C@H)1NCc2c(C1)cccc2)NCCC(=O)O
ZINC000009435667
ZINC09435667
ZINC9435667
Check stock
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Check stock on Vitas-MAvailable files
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