Vitas-M small molecule compound
4-{(E)-[2-({[3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetyl)hydrazinylidene]methyl}benzoic acid
Catalog ID
STK568632
SMILES COc1ccc(cc1)n1c(SCC(=O)N/N=C/c2ccc(cc2)C(=O)O)nc2c(c1=O)cccc2
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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 C25H20N4O5S MW 488.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20N4O5S/c1-34-19-12-10-18(11-13-19)29-23(31)20-4-2-3-5-21(20)27-25(29)35-15-22(30)28-26-14-16-6-8-17(9-7-16)24(32)33/h2-14H,15H2,1H3,(H,28,30)(H,32,33)/b26-14+InChIKey
RNYFXGGDAPAKBP-VULFUBBASA-NSynonyms
612828-91-8(E)4((2(2((3(4methoxyphenyl)4oxo34dihydroquinazolin2yl)thio)acetyl)hydrazono)methyl)benzoicacid
4((1E)2(2(3(4METHOXYPHENYL)4OXO(3HYDROQUINAZOLIN2YLTHIO))ACETYLAMINO)2AZAVINYL)BENZOICACID
4((E)((2(3(4METHOXYPHENYL)4OXOQUINAZOLIN2YL)SULFANYLACETYL)HYDRAZINYLIDENE)METHYL)BENZOICACID
4((E)(2(((3(4methoxyphenyl)4oxo34dihydroquinazolin2yl)sulfanyl)acetyl)hydrazinylidene)methyl)benzoicacid
612828918
COC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NN=CC4=CC=C(C=C4)C(=O)O
COc1ccc(cc1)n1c(SCC(=O)NN=Cc2ccc(cc2)C(=O)O)nc2c(c1=O)cccc2
InChI=1SC25H20N4O5Sc13419121018(111319)2923(31)20423521(20)2725(29)351522(30)282614166817(9716)24(32)33h214H15H21H3(H2830)(H3233)b2614+
MFCD03222663
ZINC000001279436
ZINC33332584
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.