Vitas-M small molecule compound

N'-[(1E)-1-(3,4-dichlorophenyl)ethylidene]-2-{[3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetohydrazide

Catalog ID
STL002197
SMILES COc1ccc(cc1)n1c(SCC(=O)N/N=C(/c2ccc(c(c2)Cl)Cl)\C)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 C25H20Cl2N4O3S MW 527.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20Cl2N4O3S/c1-15(16-7-12-20(26)21(27)13-16)29-30-23(32)14-35-25-28-22-6-4-3-5-19(22)24(33)31(25)17-8-10-18(34-2)11-9-17/h3-13H,14H2,1-2H3,(H,30,32)/b29-15+
InChIKey
GTLGYFJLWKPXLB-WKULSOCRSA-N
Synonyms
612828-68-9
(E)N(1(34dichlorophenyl)ethylidene)2((3(4methoxyphenyl)4oxo34dihydroquinazolin2yl)thio)acetohydrazide
612828689
CC(=NNC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)OC)C4=CC(=C(C=C4)Cl)Cl
COc1ccc(cc1)n1c(SCC(=O)NN=C(c2ccc(c(c2)Cl)Cl)C)nc2c(c1=O)cccc2
InChI=1SC25H20Cl2N4O3Sc115(1671220(26)21(27)1316)293023(32)1435252822643519(22)24(33)31(25)1781018(342)11917h313H14H212H3(H3032)b2915+
MFCD03222647
N((1E)1(34dichlorophenyl)ethylidene)2((3(4methoxyphenyl)4oxo34dihydroquinazolin2yl)sulfanyl)acetohydrazide
N((1E)2(34DICHLOROPHENYL)1AZAPROP1ENYL)2(3(4METHOXYPHENYL)4OXO(3HYDROQUINAZOLIN2YLTHIO))ACETAMIDE
N((E)1(34dichlorophenyl)ethylideneamino)2(3(4methoxyphenyl)4oxoquinazolin2yl)sulfanylacetamide
ZINC000100859150
ZINC101420327

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Available files

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