Vitas-M small molecule compound
3-benzyl-1-(4-chlorobenzyl)-5,8-dimethyl-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Catalog ID
STL135129
SMILES Cc1ccc2c(c1)c1c(n2C)c(=O)n(c(=O)n1Cc1ccc(cc1)Cl)Cc1ccccc1
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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 C26H22ClN3O2 MW 443.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22ClN3O2/c1-17-8-13-22-21(14-17)23-24(28(22)2)25(31)30(16-18-6-4-3-5-7-18)26(32)29(23)15-19-9-11-20(27)12-10-19/h3-14H,15-16H2,1-2H3InChIKey
FYITWIPXEOJLOS-UHFFFAOYSA-NSynonyms
3benzyl1((4chlorophenyl)methyl)58dimethylpyrimido(54b)indole24dione
3benzyl1(4chlorobenzyl)58dimethyl1Hpyrimido(54b)indole24(3H5H)dione
CC1=CC2=C(C=C1)N(C3=C2N(C(=O)N(C3=O)CC4=CC=CC=C4)CC5=CC=C(C=C5)Cl)C
InChI=1SC26H22ClN3O2c1178132221(1417)2324(28(22)2)25(31)30(16186435718)26(32)29(23)151991120(27)121019h314H1516H212H3
MFCD14914090
ZINC000009153654
ZINC9153654
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