Vitas-M small molecule compound

5-(3,4-dimethoxybenzyl)-5-{[(1S)-6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl]methyl}-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione

Catalog ID
STL527006
SMILES COc1cc(ccc1OC)CC1(CN2CCc3c([C@@H]2C)cc(c(c3)OC)OC)C(=O)N(C)C(=O)N(C1=O)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 C28H35N3O7 MW 525.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H35N3O7/c1-17-20-14-24(38-7)23(37-6)13-19(20)10-11-31(17)16-28(25(32)29(2)27(34)30(3)26(28)33)15-18-8-9-21(35-4)22(12-18)36-5/h8-9,12-14,17H,10-11,15-16H2,1-7H3/t17-/m0/s1
InChIKey
CAKBSYKCLKGCOG-KRWDZBQOSA-N
Synonyms
452315-98-9
(S)5((67dimethoxy1methyl34dihydroisoquinolin2(1H)yl)methyl)5(34dimethoxybenzyl)13dimethylpyrimidine246(1H3H5H)trione
452315989
5(((1~(S))67dimethoxy1methyl34dihydro1~(H)isoquinolin2yl)methyl)5((34dimethoxyphenyl)methyl)13dimethyl13diazinane246trione
5(((1S)67DIMETHOXY1METHYL34DIHYDRO1HISOQUINOLIN2YL)METHYL)5((34DIMETHOXYPHENYL)METHYL)13DIMETHYL13DIAZINANE246TRIONE
5(34dimethoxybenzyl)5(((1S)67dimethoxy1methyl34dihydroisoquinolin2(1H)yl)methyl)13dimethylpyrimidine246(1H3H5H)trione
6351022
COc1cc(ccc1OC)CC1(CN2CCc3c((C@@H)2C)cc(c(c3)OC)OC)C(=O)N(C)C(=O)N(C1=O)C
InChI=1SC28H35N3O7c117201424(387)23(376)1319(20)101131(17)1628(25(32)29(2)27(34)30(3)26(28)33)15188921(354)22(1218)365h89121417H10111516H217H3t17m0s1
MFCD03006445
ZINC000020112939
ZINC20112939

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Available files

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