Vitas-M small molecule compound

3-benzyl-1-(3-chlorobenzyl)-5,8-dimethyl-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione

Catalog ID
STL135130
SMILES Clc1cccc(c1)Cn1c(=O)n(Cc2ccccc2)c(=O)c2c1c1cc(C)ccc1n2C

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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/c1-17-11-12-22-21(13-17)23-24(28(22)2)25(31)30(15-18-7-4-3-5-8-18)26(32)29(23)16-19-9-6-10-20(27)14-19/h3-14H,15-16H2,1-2H3
InChIKey
SKMYRMYDFRWYDB-UHFFFAOYSA-N
Synonyms
887221-53-6
3benzyl1((3chlorophenyl)methyl)58dimethylpyrimido(54b)indole24dione
3benzyl1(3chlorobenzyl)58dimethyl1Hpyrimido(54b)indole24(3H5H)dione
887221536
CC1=CC2=C(C=C1)N(C3=C2N(C(=O)N(C3=O)CC4=CC=CC=C4)CC5=CC(=CC=C5)Cl)C
InChI=1SC26H22ClN3O2c11711122221(1317)2324(28(22)2)25(31)30(15187435818)26(32)29(23)1619961020(27)1419h314H1516H212H3
MFCD06751410
ZINC000009153655
ZINC09153655
ZINC9153655

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Available files

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