Vitas-M small molecule compound

N'-[(1E,2Z)-2-chloro-3-phenylprop-2-en-1-ylidene]-2-{[3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetohydrazide

Catalog ID
STL004546
SMILES COc1ccc(cc1)n1c(SCC(=O)N/N=C/C(=C/c2ccccc2)/Cl)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 C26H21ClN4O3S MW 505.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21ClN4O3S/c1-34-21-13-11-20(12-14-21)31-25(33)22-9-5-6-10-23(22)29-26(31)35-17-24(32)30-28-16-19(27)15-18-7-3-2-4-8-18/h2-16H,17H2,1H3,(H,30,32)/b19-15-,28-16+
InChIKey
MIPGGUIPPSSYHJ-GBWXPPLLSA-N
Synonyms
612828-19-0
(E)N((Z)2chloro3phenylallylidene)2((3(4methoxyphenyl)4oxo34dihydroquinazolin2yl)thio)acetohydrazide
612828190
COC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NN=CC(=CC4=CC=CC=C4)Cl
COc1ccc(cc1)n1c(SCC(=O)NN=CC(=Cc2ccccc2)Cl)nc2c(c1=O)cccc2
InChI=1SC26H21ClN4O3Sc13421131120(121421)3125(33)229561023(22)2926(31)351724(32)30281619(27)15187324818h216H17H21H3(H3032)b19152816+
MFCD03217929
N((1E2Z)2chloro3phenylprop2en1ylidene)2((3(4methoxyphenyl)4oxo34dihydroquinazolin2yl)sulfanyl)acetohydrazide
N((3Z1E)3CHLORO4PHENYL1AZABUTA13DIENYL)2(3(4METHOXYPHENYL)4OXO(3HYDROQUINAZOLIN2YLTHIO))ACETAMIDE
N((E)((Z)2CHLORO3PHENYLPROP2ENYLIDENE)AMINO)2(3(4METHOXYPHENYL)4OXOQUINAZOLIN2YL)SULFANYLACETAMIDE
ZINC000002215724
ZINC33681687

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Available files

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