Vitas-M small molecule compound
4-(3,5-dimethylphenyl)-5-(5-ethylthiophen-3-yl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK435720
SMILES CCc1scc(c1)c1nnc(n1c1cc(C)cc(c1)C)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 C16H17N3S2 MW 315.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17N3S2/c1-4-14-8-12(9-21-14)15-17-18-16(20)19(15)13-6-10(2)5-11(3)7-13/h5-9H,4H2,1-3H3,(H,18,20)InChIKey
OPPKHXCLWGNULL-UHFFFAOYSA-NSynonyms
4(35DIMETHYLPHENYL)3(5ETHYLTHIOPHEN3YL)1H124TRIAZOLE5THIONE
4(35DIMETHYLPHENYL)5(5ETHYL(3THIENYL))124TRIAZOLE3THIOL
4(35dimethylphenyl)5(5ethylthiophen3yl)4H124triazole3thiol
CCC1=CC(=CS1)C2=NNC(=S)N2C3=CC(=CC(=C3)C)C
InChI=1SC16H17N3S2c1414812(92114)15171816(20)19(15)13610(2)511(3)713h59H4H213H3(H1820)
MFCD03944101
ZINC000017053545
ZINC17053545
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