Vitas-M small molecule compound

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

Catalog ID
STK996548
SMILES O=C(CSc1nc2ccccc2c(=O)n1c1ccc(cc1)Cl)N/N=C/c1ccc(cc1)N(C)C

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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 C25H22ClN5O2S MW 492.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22ClN5O2S/c1-30(2)19-11-7-17(8-12-19)15-27-29-23(32)16-34-25-28-22-6-4-3-5-21(22)24(33)31(25)20-13-9-18(26)10-14-20/h3-15H,16H2,1-2H3,(H,29,32)/b27-15+
InChIKey
AXKWTKIDIHBUNK-JFLMPSFJSA-N
Synonyms
497822-92-1
(E)2((3(4chlorophenyl)4oxo34dihydroquinazolin2yl)thio)N(4(dimethylamino)benzylidene)acetohydrazide
2((3(4chlorophenyl)4oxo34dihydroquinazolin2yl)sulfanyl)N((E)(4(dimethylamino)phenyl)methylidene)acetohydrazide
2(3(4chlorophenyl)4oxoquinazolin2yl)sulfanylN((E)(4(dimethylamino)phenyl)methylideneamino)acetamide
2(3(4CHLOROPHENYL)4OXOQUINAZOLIN2YL)SULFANYLN((E)(4DIMETHYLAMINOPHENYL)METHYLIDENEAMINO)ACETAMIDE
497822921
CN(C)C1=CC=C(C=C1)C=NNC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)Cl
InChI=1SC25H22ClN5O2Sc130(2)1911717(81219)15272923(32)1634252822643521(22)24(33)31(25)2013918(26)101420h315H16H212H3(H2932)b2715+
MFCD03218033
N((1E)2(4(DIMETHYLAMINO)PHENYL)1AZAVINYL)2(3(4CHLOROPHENYL)4OXO(3HYDROQUINAZOLIN2YLTHIO))ACETAMIDE
O=C(CSc1nc2ccccc2c(=O)n1c1ccc(cc1)Cl)NN=Cc1ccc(cc1)N(C)C
ZINC000002236325
ZINC33351309

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Available files

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