Vitas-M small molecule compound
N-(2-methoxyethyl)-3-(4-methoxyphenyl)-2-methyl-N-[(1S,9aR)-octahydro-2H-quinolizin-1-ylmethyl]-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Catalog ID
STL548668
SMILES COCCN(C(=O)C1c2ccccc2C(=O)N(C1c1ccc(cc1)OC)C)C[C@@H]1CCCN2[C@@H]1CCCC2
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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 C31H41N3O4 MW 519.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H41N3O4/c1-32-29(22-13-15-24(38-3)16-14-22)28(25-10-4-5-11-26(25)30(32)35)31(36)34(19-20-37-2)21-23-9-8-18-33-17-7-6-12-27(23)33/h4-5,10-11,13-16,23,27-29H,6-9,12,17-21H2,1-3H3/t23-,27+,28?,29?/m0/s1InChIKey
LOPBFDPNHJCGBR-YZOZCVECSA-NSynonyms
~(N)(((1~(S)9~(a)~(R))23467899~(a)octahydro1~(H)quinolizin1yl)methyl)~(N)(2methoxyethyl)3(4methoxyphenyl)2methyl1oxo34dihydroisoquinoline4carboxamide
121541174
COCCN(C(=O)C1c2ccccc2C(=O)N(C1c1ccc(cc1)OC)C)C(C@@H)1CCCN2(C@@H)1CCCC2
InChI=1SC31H41N3O4c13229(22131524(383)161422)28(2510451126(25)30(32)35)31(36)34(1920372)212398183317761227(23)33h4510111316232729H69121721H213H3t2327+28?29?m0s1
N(2methoxyethyl)3(4methoxyphenyl)2methylN(((1S9aR)octahydro1Hquinolizin1yl)methyl)1oxo1234tetrahydroisoquinoline4carboxamide
N(2methoxyethyl)3(4methoxyphenyl)2methylN((1S9aR)octahydro2Hquinolizin1ylmethyl)1oxo1234tetrahydroisoquinoline4carboxamide
ZINC000263585715
ZINC000263585718
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