Vitas-M small molecule compound
4-(3,4-dimethylphenyl)-5-(2-phenylethyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK415378
SMILES Cc1ccc(cc1C)n1c(nnc1S)CCc1ccccc1
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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 C18H19N3S MW 309.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N3S/c1-13-8-10-16(12-14(13)2)21-17(19-20-18(21)22)11-9-15-6-4-3-5-7-15/h3-8,10,12H,9,11H2,1-2H3,(H,20,22)InChIKey
CRZBKEDZGMSSLL-UHFFFAOYSA-NSynonyms
4(34dimethylphenyl)3(2phenylethyl)1H124triazole5thione
4(34DIMETHYLPHENYL)3PHENETHYL1H124TRIAZOLE5THIONE
4(34DIMETHYLPHENYL)5(2PHENYLETHYL)124TRIAZOLE3THIOL
4(34dimethylphenyl)5(2phenylethyl)4H124triazole3thiol
CC1=C(C=C(C=C1)N2C(=NNC2=S)CCC3=CC=CC=C3)C
InChI=1SC18H19N3Sc11381016(1214(13)2)2117(192018(21)22)119156435715h381012H911H212H3(H2022)
MFCD04055270
ZINC000005926665
ZINC05926665
ZINC5926665
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