Vitas-M small molecule compound
N-[(2S)-1-(1,3-benzodioxol-5-ylamino)-1-oxopropan-2-yl]-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carboxamide
Catalog ID
STL536947
SMILES COc1cc2CCN(Cc2cc1OC)C(=O)N[C@H](C(=O)Nc1ccc2c(c1)OCO2)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 C22H25N3O6 MW 427.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N3O6/c1-13(21(26)24-16-4-5-17-20(10-16)31-12-30-17)23-22(27)25-7-6-14-8-18(28-2)19(29-3)9-15(14)11-25/h4-5,8-10,13H,6-7,11-12H2,1-3H3,(H,23,27)(H,24,26)/t13-/m0/s1InChIKey
JLGRAVVWNHTBJG-ZDUSSCGKSA-NSynonyms
956971-59-8(S)N(1(benzo(d)(13)dioxol5ylamino)1oxopropan2yl)67dimethoxy34dihydroisoquinoline2(1H)carboxamide
~(N)((2~(S))1(13benzodioxol5ylamino)1oxopropan2yl)67dimethoxy34dihydro1~(H)isoquinoline2carboxamide
16408450
956971598
COc1cc2CCN(Cc2cc1OC)C(=O)N(C@H)(C(=O)Nc1ccc2c(c1)OCO2)C
InChI=1SC22H25N3O6c113(21(26)2416451720(1016)31123017)2322(27)257614818(282)19(293)915(14)1125h4581013H671112H213H3(H2327)(H2426)t13m0s1
N((2S)1(13benzodioxol5ylamino)1oxopropan2yl)67dimethoxy34dihydroisoquinoline2(1H)carboxamide
ZINC000008764215
ZINC8764215
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