Vitas-M small molecule compound
4-{[(E)-(3-methylphenyl)methylidene]amino}-5-(5-methyl-1H-pyrazol-3-yl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STL050665
SMILES Cc1cccc(c1)/C=N/n1c(S)nnc1c1n[nH]c(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 C14H14N6S MW 298.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H14N6S/c1-9-4-3-5-11(6-9)8-15-20-13(18-19-14(20)21)12-7-10(2)16-17-12/h3-8H,1-2H3,(H,16,17)(H,19,21)/b15-8+InChIKey
RNNDPCSUSLODDH-OVCLIPMQSA-NSynonyms
849916-59-2(E)5(3methyl1Hpyrazol5yl)4((3methylbenzylidene)amino)4H124triazole3thiol
4(((E)(3methylphenyl)methylidene)amino)5(5methyl1Hpyrazol3yl)4H124triazole3thiol
4((E)(3METHYLPHENYL)METHYLIDENEAMINO)3(5METHYL1HPYRAZOL3YL)1H124TRIAZOLE5THIONE
849916592
CC1=CC=CC(=C1)C=NN2C(=NNC2=S)C3=NNC(=C3)C
Cc1cccc(c1)C=Nn1c(S)nnc1c1(nH)nc(c1)C
Cc1cccc(c1)C=Nn1c(S)nnc1c1n(nH)c(c1)C
InChI=1SC14H14N6Sc1943511(69)8152013(181914(20)21)12710(2)161712h38H12H3(H1617)(H1921)b158+
MFCD05726488
ZINC000006785751
ZINC1294845
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