Vitas-M small molecule compound

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

Catalog ID
STK108586
SMILES COc1ccc(cc1)c1nnc(n1c1ccc(cc1)Cl)SCC(=O)N/N=C/c1ccccc1C

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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/c1-17-5-3-4-6-19(17)15-27-28-23(32)16-34-25-30-29-24(18-7-13-22(33-2)14-8-18)31(25)21-11-9-20(26)10-12-21/h3-15H,16H2,1-2H3,(H,28,32)/b27-15+
InChIKey
VBKJJGFRSDVXAJ-JFLMPSFJSA-N
Synonyms
377770-38-2
(E)2((4(4chlorophenyl)5(4methoxyphenyl)4H124triazol3yl)thio)N(2methylbenzylidene)acetohydrazide
2((4(4CHLOROPHENYL)5(4METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)N((E)(2METHYLPHENYL)METHYLIDENEAMINO)ACETAMIDE
2((4(4CHLOROPHENYL)5(4METHOXYPHENYL)4H124TRIAZOL3YL)SULFANYL)N((E)(2METHYLPHENYL)METHYLIDENE)ACETOHYDRAZIDE
377770382
CC1=CC=CC=C1C=NNC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)OC
COc1ccc(cc1)c1nnc(n1c1ccc(cc1)Cl)SCC(=O)NN=Cc1ccccc1C
InChI=1SC25H22ClN5O2Sc117534619(17)15272823(32)163425302924(1871322(332)14818)31(25)2111920(26)101221h315H16H212H3(H2832)b2715+
MFCD02714515
N((1E)2(2METHYLPHENYL)1AZAVINYL)2(4(4CHLOROPHENYL)5(4METHOXYPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000001836107
ZINC33345304

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Available files

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