Vitas-M small molecule compound
N-[(2S)-1-(benzylamino)-1-oxo-3-phenylpropan-2-yl]-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carboxamide
Catalog ID
STL535032
SMILES COc1cc2CN(CCc2cc1OC)C(=O)N[C@H](C(=O)NCc1ccccc1)Cc1ccccc1
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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 C28H31N3O4 MW 473.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N3O4/c1-34-25-16-22-13-14-31(19-23(22)17-26(25)35-2)28(33)30-24(15-20-9-5-3-6-10-20)27(32)29-18-21-11-7-4-8-12-21/h3-12,16-17,24H,13-15,18-19H2,1-2H3,(H,29,32)(H,30,33)/t24-/m0/s1InChIKey
IVOQQUJEYUJPOX-DEOSSOPVSA-NSynonyms
956984-28-4(S)N(1(benzylamino)1oxo3phenylpropan2yl)67dimethoxy34dihydroisoquinoline2(1H)carboxamide
~(N)((2~(S))1(benzylamino)1oxo3phenylpropan2yl)67dimethoxy34dihydro1~(H)isoquinoline2carboxamide
16408538
956984284
COc1cc2CN(CCc2cc1OC)C(=O)N(C@H)(C(=O)NCc1ccccc1)Cc1ccccc1
InChI=1SC28H31N3O4c134251622131431(1923(22)1726(25)352)28(33)3024(152095361020)27(32)291821117481221h312161724H13151819H212H3(H2932)(H3033)t24m0s1
N((2S)1(benzylamino)1oxo3phenylpropan2yl)67dimethoxy34dihydroisoquinoline2(1H)carboxamide
ZINC000008764337
ZINC8764337
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