Vitas-M small molecule compound

N'-[(E)-(4-chloro-3-nitrophenyl)methylidene]-2-{[3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetohydrazide

Catalog ID
STL050838
SMILES COc1ccc(cc1)n1c(SCC(=O)N/N=C/c2ccc(c(c2)[N+](=O)[O-])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 C24H18ClN5O5S MW 523.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H18ClN5O5S/c1-35-17-9-7-16(8-10-17)29-23(32)18-4-2-3-5-20(18)27-24(29)36-14-22(31)28-26-13-15-6-11-19(25)21(12-15)30(33)34/h2-13H,14H2,1H3,(H,28,31)/b26-13+
InChIKey
IWRRPXJCCFIDSM-LGJNPRDNSA-N
Synonyms
612828-87-2
(E)N(4chloro3nitrobenzylidene)2((3(4methoxyphenyl)4oxo34dihydroquinazolin2yl)thio)acetohydrazide
612828872
COC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NN=CC4=CC(=C(C=C4)Cl)(N+)(=O)(O)
COc1ccc(cc1)n1c(SCC(=O)NN=Cc2ccc(c(c2)(N+)(=O)(O))Cl)nc2c(c1=O)cccc2
InChI=1SC24H18ClN5O5Sc135179716(81017)2923(32)18423520(18)2724(29)361422(31)2826131561119(25)21(1215)30(33)34h213H14H21H3(H2831)b2613+
MFCD03222661
N((1E)2(4CHLORO3NITROPHENYL)1AZAVINYL)2(3(4METHOXYPHENYL)4OXO(3HYDROQUINAZOLIN2YLTHIO))ACETAMIDE
N((E)(4chloro3nitrophenyl)methylidene)2((3(4methoxyphenyl)4oxo34dihydroquinazolin2yl)sulfanyl)acetohydrazide
N((E)(4CHLORO3NITROPHENYL)METHYLIDENEAMINO)2(3(4METHOXYPHENYL)4OXOQUINAZOLIN2YL)SULFANYLACETAMIDE
ZINC000001853531
ZINC103118985

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Available files

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