Vitas-M small molecule compound
N-[3-(azepan-1-yl)-3-oxopropyl]-6,7-dimethoxy-1-(4-methoxyphenyl)-3,4-dihydroisoquinoline-2(1H)-carboxamide
Catalog ID
STL540159
SMILES COc1ccc(cc1)C1N(CCc2c1cc(OC)c(c2)OC)C(=O)NCCC(=O)N1CCCCCC1
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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 C28H37N3O5 MW 495.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H37N3O5/c1-34-22-10-8-20(9-11-22)27-23-19-25(36-3)24(35-2)18-21(23)13-17-31(27)28(33)29-14-12-26(32)30-15-6-4-5-7-16-30/h8-11,18-19,27H,4-7,12-17H2,1-3H3,(H,29,33)InChIKey
LXXKSQOZGFUFKQ-UHFFFAOYSA-NSynonyms
919733-60-1~(N)(3(azepan1yl)3oxopropyl)67dimethoxy1(4methoxyphenyl)34dihydro1~(H)isoquinoline2carboxamide
16408134
919733601
InChI=1SC28H37N3O5c1342210820(91122)27231925(363)24(352)1821(23)131731(27)28(33)29141226(32)301564571630h811181927H471217H213H3(H2933)
MFCD08742445
N(3(azepan1yl)3oxopropyl)67dimethoxy1(4methoxyphenyl)34dihydroisoquinoline2(1H)carboxamide
ZINC000012894199
ZINC000012894207
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