Vitas-M small molecule compound

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

Catalog ID
STL002787
SMILES O=C(CSc1nc2ccccc2c(=O)n1c1ccc(cc1)Cl)N/N=C/c1ccc(c(c1)Cl)Cl

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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 C23H15Cl3N4O2S MW 517.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H15Cl3N4O2S/c24-15-6-8-16(9-7-15)30-22(32)17-3-1-2-4-20(17)28-23(30)33-13-21(31)29-27-12-14-5-10-18(25)19(26)11-14/h1-12H,13H2,(H,29,31)/b27-12+
InChIKey
CJMLYNCYQCJGTB-KKMKTNMSSA-N
Synonyms
612829-43-3
(E)2((3(4chlorophenyl)4oxo34dihydroquinazolin2yl)thio)N(34dichlorobenzylidene)acetohydrazide
2((3(4chlorophenyl)4oxo34dihydroquinazolin2yl)sulfanyl)N((E)(34dichlorophenyl)methylidene)acetohydrazide
2(3(4CHLOROPHENYL)4OXOQUINAZOLIN2YL)SULFANYLN((E)(34DICHLOROPHENYL)METHYLIDENEAMINO)ACETAMIDE
612829433
C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC(=O)NN=CC3=CC(=C(C=C3)Cl)Cl)C4=CC=C(C=C4)Cl
InChI=1SC23H15Cl3N4O2Sc24156816(9715)3022(32)17312420(17)2823(30)331321(31)2927121451018(25)19(26)1114h112H13H2(H2931)b2712+
MFCD03222704
N((1E)2(34DICHLOROPHENYL)1AZAVINYL)2(3(4CHLOROPHENYL)4OXO(3HYDROQUINAZOLIN2YLTHIO))ACETAMIDE
O=C(CSc1nc2ccccc2c(=O)n1c1ccc(cc1)Cl)NN=Cc1ccc(c(c1)Cl)Cl
ZINC000002233564
ZINC101420273

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Available files

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