Vitas-M small molecule compound

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

Catalog ID
STK610638
SMILES Clc1ccc(cc1)n1c(/C=C/c2c(C)[nH]c3c2cccc3)nc2c(c1=O)cc(cc2)I

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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 C25H17ClIN3O MW 537.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17ClIN3O/c1-15-19(20-4-2-3-5-22(20)28-15)11-13-24-29-23-12-8-17(27)14-21(23)25(31)30(24)18-9-6-16(26)7-10-18/h2-14,28H,1H3/b13-11+
InChIKey
LKUSTLKBFBQOJC-ACCUITESSA-N
Synonyms
799791-57-4
(E)3(4chlorophenyl)6iodo2(2(2methyl1Hindol3yl)vinyl)quinazolin4(3H)one
3(4chlorophenyl)6iodo2((E)2(2methyl1Hindol3yl)ethenyl)quinazolin4(3H)one
3(4CHLOROPHENYL)6IODO2((E)2(2METHYL1HINDOL3YL)ETHENYL)QUINAZOLIN4ONE
799791574
CC1=C(C2=CC=CC=C2N1)C=CC3=NC4=C(C=C(C=C4)I)C(=O)N3C5=CC=C(C=C5)Cl
Clc1ccc(cc1)n1c(C=Cc2c(C)(nH)c3c2cccc3)nc2c(c1=O)cc(cc2)I
InChI=1SC25H17ClIN3Oc11519(20423522(20)2815)111324292312817(27)1421(23)25(31)30(24)189616(26)71018h21428H1H3b1311+
MFCD03676358
ZINC000100023741
ZINC100023741

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Available files

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