Vitas-M small molecule compound
1-(4-chlorobenzyl)-8-methoxy-5-methyl-3-(4-methylphenyl)-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Catalog ID
STL135141
SMILES COc1ccc2c(c1)c1n(Cc3ccc(cc3)Cl)c(=O)n(c(=O)c1n2C)c1ccc(cc1)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 C26H22ClN3O3 MW 459.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22ClN3O3/c1-16-4-10-19(11-5-16)30-25(31)24-23(21-14-20(33-3)12-13-22(21)28(24)2)29(26(30)32)15-17-6-8-18(27)9-7-17/h4-14H,15H2,1-3H3InChIKey
UXSZMFKZSVSSIB-UHFFFAOYSA-NSynonyms
1((4chlorophenyl)methyl)8methoxy5methyl3(4methylphenyl)pyrimido(54b)indole24dione
1(4chlorobenzyl)8methoxy5methyl3(4methylphenyl)1Hpyrimido(54b)indole24(3H5H)dione
CC1=CC=C(C=C1)N2C(=O)C3=C(C4=C(N3C)C=CC(=C4)OC)N(C2=O)CC5=CC=C(C=C5)Cl
InChI=1SC26H22ClN3O3c11641019(11516)3025(31)2423(211420(333)121322(21)28(24)2)29(26(30)32)15176818(27)9717h414H15H213H3
MFCD14914128
ZINC000020558156
ZINC20558156
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