Vitas-M small molecule compound
5-(5-methyl-1H-pyrazol-3-yl)-4-{[(E)-(2,3,4-trimethoxyphenyl)methylidene]amino}-4H-1,2,4-triazole-3-thiol
Catalog ID
STL057461
SMILES COc1ccc(c(c1OC)OC)/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 C16H18N6O3S MW 374.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N6O3S/c1-9-7-11(19-18-9)15-20-21-16(26)22(15)17-8-10-5-6-12(23-2)14(25-4)13(10)24-3/h5-8H,1-4H3,(H,18,19)(H,21,26)/b17-8+InChIKey
WKGXUKXCUJVXTP-CAOOACKPSA-NSynonyms
716333-15-2(E)5(3methyl1Hpyrazol5yl)4((234trimethoxybenzylidene)amino)4H124triazole3thiol
3(5METHYL1HPYRAZOL3YL)4((E)(234TRIMETHOXYPHENYL)METHYLIDENEAMINO)1H124TRIAZOLE5THIONE
4((1E)2(234TRIMETHOXYPHENYL)1AZAVINYL)5(3METHYLPYRAZOL5YL)124TRIAZOLE3THIOL
5(5methyl1Hpyrazol3yl)4(((E)(234trimethoxyphenyl)methylidene)amino)4H124triazole3thiol
716333152
CC1=CC(=NN1)C2=NNC(=S)N2N=CC3=C(C(=C(C=C3)OC)OC)OC
COc1ccc(c(c1OC)OC)C=Nn1c(S)nnc1c1(nH)nc(c1)C
COc1ccc(c(c1OC)OC)C=Nn1c(S)nnc1c1n(nH)c(c1)C
InChI=1SC16H18N6O3Sc19711(19189)15202116(26)22(15)178105612(232)14(254)13(10)243h58H14H3(H1819)(H2126)b178+
MFCD05738187
ZINC000005625915
ZINC33332574
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