Vitas-M small molecule compound

(3S)-2-({2-hydroxy-5-oxo-1-[4-(propan-2-yl)phenyl]-4,5-dihydro-1H-imidazol-4-yl}acetyl)-N-methyl-1,2,3,4-tetrahydroisoquinoline-3-carboxamide

Catalog ID
STL545247
SMILES CNC(=O)[C@@H]1Cc2ccccc2CN1C(=O)CC1N=C(N(C1=O)c1ccc(cc1)C(C)C)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 C25H28N4O4 MW 448.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N4O4/c1-15(2)16-8-10-19(11-9-16)29-24(32)20(27-25(29)33)13-22(30)28-14-18-7-5-4-6-17(18)12-21(28)23(31)26-3/h4-11,15,20-21H,12-14H2,1-3H3,(H,26,31)(H,27,33)/t20?,21-/m0/s1
InChIKey
PHPGQHAGGKGOAW-LBAQZLPGSA-N
Synonyms

(3~(S))2(2(25dioxo1(4propan2ylphenyl)imidazolidin4yl)acetyl)~(N)methyl34dihydro1~(H)isoquinoline3carboxamide
(3S)2((2hydroxy5oxo1(4(propan2yl)phenyl)45dihydro1Himidazol4yl)acetyl)Nmethyl1234tetrahydroisoquinoline3carboxamide
135639710
InChI=1SC25H28N4O4c115(2)1681019(11916)2924(32)20(2725(29)33)1322(30)281418754617(18)1221(28)23(31)263h411152021H1214H213H3(H2631)(H2733)t20?21m0s1
ZINC000253411925
ZINC000409414833

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Available files

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