Vitas-M small molecule compound

N'-[(E)-(2-nitrophenyl)methylidene]-2-[(4-oxo-3-phenyl-3,4-dihydroquinazolin-2-yl)sulfanyl]acetohydrazide

Catalog ID
STK108889
SMILES O=C(CSc1nc2ccccc2c(=O)n1c1ccccc1)N/N=C/c1ccccc1[N+](=O)[O-]

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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 C23H17N5O4S MW 459.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17N5O4S/c29-21(26-24-14-16-8-4-7-13-20(16)28(31)32)15-33-23-25-19-12-6-5-11-18(19)22(30)27(23)17-9-2-1-3-10-17/h1-14H,15H2,(H,26,29)/b24-14+
InChIKey
IHNFBRJNECERKK-ZVHZXABRSA-N
Synonyms
497823-92-4
(E)N(2nitrobenzylidene)2((4oxo3phenyl34dihydroquinazolin2yl)thio)acetohydrazide
497823924
C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NN=CC4=CC=CC=C4(N+)(=O)(O)
InChI=1SC23H17N5O4Sc2921(262414168471320(16)28(31)32)153323251912651118(19)22(30)27(23)1792131017h114H15H2(H2629)b2414+
MFCD01588483
N((1E)2(2NITROPHENYL)1AZAVINYL)2(4OXO3PHENYL(3HYDROQUINAZOLIN2YLTHIO))ACETAMIDE
N((E)(2NITROPHENYL)METHYLIDENE)2((4OXO3PHENYL34DIHYDROQUINAZOLIN2YL)SULFANYL)ACETOHYDRAZIDE
N((E)(2NITROPHENYL)METHYLIDENEAMINO)2(4OXO3PHENYLQUINAZOLIN2YL)SULFANYLACETAMIDE
O=C(CSc1nc2ccccc2c(=O)n1c1ccccc1)NN=Cc1ccccc1(N+)(=O)(O)
ZINC000009357765
ZINC33333737

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Available files

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