Vitas-M small molecule compound

6-iodo-2-[(Z)-(1-methyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-3-(2-methylphenyl)quinazolin-4(3H)-one

Catalog ID
STK530908
SMILES Ic1ccc2c(c1)c(=O)n(c(n2)/C=C/1\C(=O)N(c2c1cccc2)C)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 C25H18IN3O2 MW 519.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18IN3O2/c1-15-7-3-5-9-21(15)29-23(27-20-12-11-16(26)13-19(20)25(29)31)14-18-17-8-4-6-10-22(17)28(2)24(18)30/h3-14H,1-2H3/b18-14-
InChIKey
MKFSHPPARHUNPS-JXAWBTAJSA-N
Synonyms

(Z)6iodo2((1methyl2oxoindolin3ylidene)methyl)3(otolyl)quinazolin4(3H)one
6iodo2((Z)(1methyl2oxo12dihydro3Hindol3ylidene)methyl)3(2methylphenyl)quinazolin4(3H)one
6IODO2((Z)(1METHYL2OXOINDOL3YLIDENE)METHYL)3(2METHYLPHENYL)QUINAZOLIN4ONE
CC1=CC=CC=C1N2C(=NC3=C(C2=O)C=C(C=C3)I)C=C4C5=CC=CC=C5N(C4=O)C
Ic1ccc2c(c1)c(=O)n(c(n2)C=C1C(=O)N(c2c1cccc2)C)c1ccccc1C
InChI=1SC25H18IN3O2c115735921(15)2923(2720121116(26)1319(20)25(29)31)1418178461022(17)28(2)24(18)30h314H12H3b1814
MFCD02240675
ZINC000100022644
ZINC100022644

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Available files

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