Vitas-M small molecule compound

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

Catalog ID
STK105080
SMILES O=C(CSc1nnc(n1c1ccc(cc1)Cl)c1ccc(cc1)C)N/N=C/c1cccc(c1)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 C25H22ClN5OS MW 476.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22ClN5OS/c1-17-6-8-20(9-7-17)24-29-30-25(31(24)22-12-10-21(26)11-13-22)33-16-23(32)28-27-15-19-5-3-4-18(2)14-19/h3-15H,16H2,1-2H3,(H,28,32)/b27-15+
InChIKey
GBLBZOBOQBOFAZ-JFLMPSFJSA-N
Synonyms
488086-31-3
(E)2((4(4chlorophenyl)5(ptolyl)4H124triazol3yl)thio)N(3methylbenzylidene)acetohydrazide
2((4(4CHLOROPHENYL)5(4METHYLPHENYL)124TRIAZOL3YL)SULFANYL)N((E)(3METHYLPHENYL)METHYLIDENEAMINO)ACETAMIDE
2((4(4CHLOROPHENYL)5(4METHYLPHENYL)4H124TRIAZOL3YL)SULFANYL)N((E)(3METHYLPHENYL)METHYLIDENE)ACETOHYDRAZIDE
488086313
CC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)Cl)SCC(=O)NN=CC4=CC(=CC=C4)C
InChI=1SC25H22ClN5OSc1176820(9717)24293025(31(24)22121021(26)111322)331623(32)2827151953418(2)1419h315H16H212H3(H2832)b2715+
MFCD03220121
N((1E)2(3METHYLPHENYL)1AZAVINYL)2(4(4CHLOROPHENYL)5(4METHYLPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
O=C(CSc1nnc(n1c1ccc(cc1)Cl)c1ccc(cc1)C)NN=Cc1cccc(c1)C
ZINC000001800637
ZINC33344432

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Available files

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