Vitas-M small molecule compound

4-[(3,4-dichlorobenzylidene)amino]-5-(4-methoxyphenyl)-4H-1,2,4-triazole-3-thiol

Catalog ID
STK105083
SMILES COc1ccc(cc1)c1nnc(n1/N=C\c1ccc(c(c1)Cl)Cl)S

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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 C16H12Cl2N4OS MW 379.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12Cl2N4OS/c1-23-12-5-3-11(4-6-12)15-20-21-16(24)22(15)19-9-10-2-7-13(17)14(18)8-10/h2-9H,1H3,(H,21,24)
InChIKey
DMTQHSLTEBUADC-UHFFFAOYSA-N
Synonyms

(E)4((34dichlorobenzylidene)amino)5(4methoxyphenyl)4H124triazole3thiol
4((1Z)2(34DICHLOROPHENYL)1AZAVINYL)5(4METHOXYPHENYL)124TRIAZOLE3THIOL
4((34DICHLOROBENZYLIDENE)AMINO)5(4METHOXYPHENYL)4H124TRIAZOLE3THIOL
4((34DICHLOROPHENYL)METHYLIDENEAMINO)3(4METHOXYPHENYL)1H124TRIAZOLE5THIONE
COC1=CC=C(C=C1)C2=NNC(=S)N2N=CC3=CC(=C(C=C3)Cl)Cl
COc1ccc(cc1)c1nnc(n1N=Cc1ccc(c(c1)Cl)Cl)S
InChI=1SC16H12Cl2N4OSc123125311(4612)15202116(24)22(15)199102713(17)14(18)810h29H1H3(H2124)
MFCD02923792
ZINC000239038590

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Available files

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