Vitas-M small molecule compound
5-[4-(benzyloxy)benzyl]-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
STL526644
SMILES COc1cc2c(cc1OC)CCN([C@H]2C)CC1(Cc2ccc(cc2)OCc2ccccc2)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 C33H37N3O6 MW 571.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H37N3O6/c1-22-27-18-29(41-5)28(40-4)17-25(27)15-16-36(22)21-33(30(37)34(2)32(39)35(3)31(33)38)19-23-11-13-26(14-12-23)42-20-24-9-7-6-8-10-24/h6-14,17-18,22H,15-16,19-21H2,1-5H3/t22-/m0/s1InChIKey
TYTYMACEYURKTQ-QFIPXVFZSA-NSynonyms
447458-02-8(S)5(4(benzyloxy)benzyl)5((67dimethoxy1methyl34dihydroisoquinolin2(1H)yl)methyl)13dimethylpyrimidine246(1H3H5H)trione
16397378
447458028
5(((1~(S))67dimethoxy1methyl34dihydro1~(H)isoquinolin2yl)methyl)13dimethyl5((4phenylmethoxyphenyl)methyl)13diazinane246trione
5(4(benzyloxy)benzyl)5(((1S)67dimethoxy1methyl34dihydroisoquinolin2(1H)yl)methyl)13dimethylpyrimidine246(1H3H5H)trione
COc1cc2c(cc1OC)CCN((C@H)2C)CC1(Cc2ccc(cc2)OCc2ccccc2)C(=O)N(C)C(=O)N(C1=O)C
InChI=1SC33H37N3O6c122271829(415)28(404)1725(27)151636(22)2133(30(37)34(2)32(39)35(3)31(33)38)1923111326(141223)42202497681024h614171822H15161921H215H3t22m0s1
MFCD01845620
ZINC000070670228
ZINC70670228
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