Vitas-M small molecule compound

2-{[4-(4-chlorophenyl)-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1E,2E)-3-(furan-2-yl)-2-methylprop-2-en-1-ylidene]acetohydrazide

Catalog ID
STK108164
SMILES O=C(CSc1nnc(n1c1ccc(cc1)Cl)c1ccc(cc1)C)N/N=C/C(=C/c1ccco1)/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/c1-17-5-7-19(8-6-17)24-29-30-25(31(24)21-11-9-20(26)10-12-21)34-16-23(32)28-27-15-18(2)14-22-4-3-13-33-22/h3-15H,16H2,1-2H3,(H,28,32)/b18-14+,27-15+
InChIKey
HPKPFWGGTPETNL-SZNNBBDXSA-N
Synonyms
488718-10-1
(E)2((4(4chlorophenyl)5(ptolyl)4H124triazol3yl)thio)N((E)3(furan2yl)2methylallylidene)acetohydrazide
2((4(4CHLOROPHENYL)5(4METHYLPHENYL)124TRIAZOL3YL)SULFANYL)N((E)((E)3(FURAN2YL)2METHYLPROP2ENYLIDENE)AMINO)ACETAMIDE
2((4(4CHLOROPHENYL)5(4METHYLPHENYL)4H124TRIAZOL3YL)SULFANYL)N((1E2E)3(FURAN2YL)2METHYLPROP2EN1YLIDENE)ACETOHYDRAZIDE
488718101
CC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)Cl)SCC(=O)NN=CC(=CC4=CC=CO4)C
InChI=1SC25H22ClN5O2Sc1175719(8617)24293025(31(24)2111920(26)101221)341623(32)28271518(2)142243133322h315H16H212H3(H2832)b1814+2715+
MFCD03220137
N((1E3E)4(2FURYL)3METHYL1AZABUTA13DIENYL)2(4(4CHLOROPHENYL)5(4METHYLPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
O=C(CSc1nnc(n1c1ccc(cc1)Cl)c1ccc(cc1)C)NN=CC(=Cc1ccco1)C
ZINC000002337130
ZINC33628783

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Available files

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