Vitas-M small molecule compound

6-iodo-2-[(E)-2-(2-methyl-1H-indol-3-yl)ethenyl]-3-(2-methylphenyl)quinazolin-4(3H)-one

Catalog ID
STK835443
SMILES Ic1ccc2c(c1)c(=O)n(c(n2)/C=C/c1c(C)[nH]c2c1cccc2)c1ccccc1C

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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 C26H20IN3O MW 517.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20IN3O/c1-16-7-3-6-10-24(16)30-25(29-23-13-11-18(27)15-21(23)26(30)31)14-12-19-17(2)28-22-9-5-4-8-20(19)22/h3-15,28H,1-2H3/b14-12+
InChIKey
BEXCXHRMCQLZKR-WYMLVPIESA-N
Synonyms

(E)6iodo2(2(2methyl1Hindol3yl)vinyl)3(otolyl)quinazolin4(3H)one
6iodo2((E)2(2methyl1Hindol3yl)ethenyl)3(2methylphenyl)quinazolin4(3H)one
6IODO2((E)2(2METHYL1HINDOL3YL)ETHENYL)3(2METHYLPHENYL)QUINAZOLIN4ONE
CC1=CC=CC=C1N2C(=NC3=C(C2=O)C=C(C=C3)I)C=CC4=C(NC5=CC=CC=C54)C
Ic1ccc2c(c1)c(=O)n(c(n2)C=Cc1c(C)(nH)c2c1cccc2)c1ccccc1C
InChI=1SC26H20IN3Oc1167361024(16)3025(2923131118(27)1521(23)26(30)31)14121917(2)2822954820(19)22h31528H12H3b1412+
MFCD02239698
ZINC000009057560
ZINC09057560
ZINC9057560

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.