Vitas-M small molecule compound
(3S)-N-[(2S)-1-(cyclohexylamino)-3-methyl-1-oxobutan-2-yl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Catalog ID
STK590895
SMILES CC([C@@H](C(=O)NC1CCCCC1)NC(=O)[C@H]1NCc2c(C1)cccc2)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 C21H31N3O2 MW 357.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H31N3O2/c1-14(2)19(21(26)23-17-10-4-3-5-11-17)24-20(25)18-12-15-8-6-7-9-16(15)13-22-18/h6-9,14,17-19,22H,3-5,10-13H2,1-2H3,(H,23,26)(H,24,25)/t18-,19-/m0/s1InChIKey
WNYJHPPZISCSFD-OALUTQOASA-NSynonyms
(3S)N((2S)1(cyclohexylamino)3methyl1oxobutan2yl)1234tetrahydroisoquinoline3carboxamide
(S)N((S)1(cyclohexylamino)3methyl1oxobutan2yl)1234tetrahydroisoquinoline3carboxamidehydrochloride
CC((C@@H)(C(=O)NC1CCCCC1)NC(=O)(C@H)1NCc2c(C1)cccc2)C
CC((C@@H)(C(=O)NC1CCCCC1)NC(=O)(C@H)1NCc2c(C1)cccc2)CCl
CC(C)C(C(=O)NC1CCCCC1)NC(=O)C2CC3=CC=CC=C3CN2
InChI=1SC21H31N3O2c114(2)19(21(26)2317104351117)2420(25)181215867916(15)132218h6914171922H351013H212H3(H2326)(H2425)t1819m0s1
MFCD06770651
ZINC000035485353
ZINC35485353
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