Vitas-M small molecule compound

4-{[(E)-(4-chlorophenyl)methylidene]amino}-5-(5-phenyl-1H-pyrazol-3-yl)-4H-1,2,4-triazole-3-thiol

Catalog ID
STL049100
SMILES Clc1ccc(cc1)/C=N/n1c(S)nnc1c1n[nH]c(c1)c1ccccc1

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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 C18H13ClN6S MW 380.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13ClN6S/c19-14-8-6-12(7-9-14)11-20-25-17(23-24-18(25)26)16-10-15(21-22-16)13-4-2-1-3-5-13/h1-11H,(H,21,22)(H,24,26)/b20-11+
InChIKey
QQJCLGLEPLVBFZ-RGVLZGJSSA-N
Synonyms
850763-30-3
(E)4((4chlorobenzylidene)amino)5(3phenyl1Hpyrazol5yl)4H124triazole3thiol
4(((E)(4chlorophenyl)methylidene)amino)5(5phenyl1Hpyrazol3yl)4H124triazole3thiol
4((1(4CHLOROPHENYL)METH(E)YLIDENE)AMINO)5(5PHENYL2HPYRAZOL3YL)4H(124)TRIAZOLE3THIOL
4((1E)2(4CHLOROPHENYL)1AZAVINYL)5(3PHENYLPYRAZOL5YL)124TRIAZOLE3THIOL
4((4CHLOROBENZYLIDENE)AMINO)3(3PHENYL1HPYRAZOL5YL)1H124TRIAZOLE5THIONE
4((4CHLOROPHENYL)METHYLIDENEAMINO)3(3PHENYL1HPYRAZOL5YL)1H124TRIAZOLE5THIONE
4((E)(4CHLOROPHENYL)METHYLIDENEAMINO)3(3PHENYL1HPYRAZOL5YL)1H124TRIAZOLE5THIONE
850763303
C1=CC=C(C=C1)C2=NNC(=C2)C3=NNC(=S)N3N=CC4=CC=C(C=C4)Cl
Clc1ccc(cc1)C=Nn1c(S)nnc1c1(nH)nc(c1)c1ccccc1
Clc1ccc(cc1)C=Nn1c(S)nnc1c1n(nH)c(c1)c1ccccc1
InChI=1SC18H13ClN6Sc19148612(7914)11202517(232418(25)26)161015(212216)134213513h111H(H2122)(H2426)b2011+
MFCD05731486
ZINC000005626428
ZINC15987718

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Available files

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