Vitas-M small molecule compound

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

Catalog ID
STL055921
SMILES Cc1ccsc1/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 C17H14N6S2 MW 366.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14N6S2/c1-11-7-8-25-15(11)10-18-23-16(21-22-17(23)24)14-9-13(19-20-14)12-5-3-2-4-6-12/h2-10H,1H3,(H,19,20)(H,22,24)/b18-10+
InChIKey
JYXBPKCFOJNZEJ-VCHYOVAHSA-N
Synonyms
850160-85-9
(E)4(((3methylthiophen2yl)methylene)amino)5(3phenyl1Hpyrazol5yl)4H124triazole3thiol
4(((E)(3methylthiophen2yl)methylidene)amino)5(5phenyl1Hpyrazol3yl)4H124triazole3thiol
4((1(3METHYLTHIOPHEN2YL)METH(E)YLIDENE)AMINO)5(5PHENYL2HPYRAZOL3YL)4H(124)TRIAZOLE3THIOL
4((1E)2(3METHYL(2THIENYL))1AZAVINYL)5(3PHENYLPYRAZOL5YL)124TRIAZOLE3THIOL
4((E)(3METHYL2THIENYL)METHYLENEAMINO)3(3PHENYL1HPYRAZOL5YL)1H124TRIAZOLE5THIONE
4((E)(3METHYL2THIOPHENYL)METHYLIDENEAMINO)3(3PHENYL1HPYRAZOL5YL)1H124TRIAZOLE5THIONE
4((E)(3METHYLTHIOPHEN2YL)METHYLIDENEAMINO)3(3PHENYL1HPYRAZOL5YL)1H124TRIAZOLE5THIONE
850160859
CC1=C(SC=C1)C=NN2C(=NNC2=S)C3=CC(=NN3)C4=CC=CC=C4
Cc1ccsc1C=Nn1c(S)nnc1c1(nH)nc(c1)c1ccccc1
Cc1ccsc1C=Nn1c(S)nnc1c1n(nH)c(c1)c1ccccc1
InChI=1SC17H14N6S2c111782515(11)10182316(212217(23)24)14913(192014)125324612h210H1H3(H1920)(H2224)b1810+
MFCD05729331
ZINC000006785793
ZINC15987729

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Available files

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