Vitas-M small molecule compound
N-[(3R)-3-(4-chlorophenyl)-4-{[(3S)-1,2,3,4-tetrahydroisoquinolin-3-ylcarbonyl]amino}butanoyl]-D-alanine
Catalog ID
STK613318
SMILES O=C(CC(c1ccc(cc1)Cl)CNC(=O)[C@H]1NCc2c(C1)cccc2)N[C@@H](C(=O)O)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 C23H26ClN3O4 MW 443.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26ClN3O4/c1-14(23(30)31)27-21(28)11-18(15-6-8-19(24)9-7-15)13-26-22(29)20-10-16-4-2-3-5-17(16)12-25-20/h2-9,14,18,20,25H,10-13H2,1H3,(H,26,29)(H,27,28)(H,30,31)/t14-,18+,20+/m1/s1InChIKey
RZVSRXZQGHHOQZ-WNYOCNMUSA-NSynonyms
(2R)2(((3R)3(4chlorophenyl)4(((3S)1234tetrahydroisoquinoline3carbonyl)amino)butanoyl)amino)propanoicacid(S)2((R)3(4chlorophenyl)4((S)1234tetrahydroisoquinoline3carboxamido)butanamido)propanoicacidhydrochloride
CC(C(=O)O)NC(=O)CC(CNC(=O)C1CC2=CC=CC=C2CN1)C3=CC=C(C=C3)Cl
N((3R)3(4chlorophenyl)4(((3S)1234tetrahydroisoquinolin3ylcarbonyl)amino)butanoyl)Dalanine
O=C(C(C@H)(c1ccc(cc1)Cl)CNC(=O)(C@H)1NCc2c(C1)cccc2)N(C@H)(C(=O)O)CCl
O=C(CC(c1ccc(cc1)Cl)CNC(=O)(C@H)1NCc2c(C1)cccc2)N(C@@H)(C(=O)O)C
Registry IDs
MFCD08292597ZINC000013548275
ZINC13548275
Check stock
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Check stock on Vitas-MAvailable files
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