Vitas-M small molecule compound
N-[(2S)-1-(1,3-benzodioxol-5-ylamino)-4-methyl-1-oxopentan-2-yl]-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carboxamide
Catalog ID
STL535095
SMILES COc1cc2CCN(Cc2cc1OC)C(=O)N[C@H](C(=O)Nc1ccc2c(c1)OCO2)CC(C)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 C25H31N3O6 MW 469.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31N3O6/c1-15(2)9-19(24(29)26-18-5-6-20-23(12-18)34-14-33-20)27-25(30)28-8-7-16-10-21(31-3)22(32-4)11-17(16)13-28/h5-6,10-12,15,19H,7-9,13-14H2,1-4H3,(H,26,29)(H,27,30)/t19-/m0/s1InChIKey
MGEOCXYMTJRQAS-IBGZPJMESA-NSynonyms
957033-62-4(S)N(1(benzo(d)(13)dioxol5ylamino)4methyl1oxopentan2yl)67dimethoxy34dihydroisoquinoline2(1H)carboxamide
~(N)((2~(S))1(13benzodioxol5ylamino)4methyl1oxopentan2yl)67dimethoxy34dihydro1~(H)isoquinoline2carboxamide
16408104
957033624
COc1cc2CCN(Cc2cc1OC)C(=O)N(C@H)(C(=O)Nc1ccc2c(c1)OCO2)CC(C)C
InChI=1SC25H31N3O6c115(2)919(24(29)2618562023(1218)34143320)2725(30)2887161021(313)22(324)1117(16)1328h5610121519H791314H214H3(H2629)(H2730)t19m0s1
N((2S)1(13benzodioxol5ylamino)4methyl1oxopentan2yl)67dimethoxy34dihydroisoquinoline2(1H)carboxamide
ZINC000012893948
ZINC12893948
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