Vitas-M small molecule compound
1-(3-chloro-4-methylphenyl)-5-methyl-N-[2-(thiophen-2-yl)ethyl]-1H-1,2,3-triazole-4-carboxamide
Catalog ID
STK986624
SMILES O=C(c1nnn(c1C)c1ccc(c(c1)Cl)C)NCCc1cccs1
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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 C17H17ClN4OS MW 360.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17ClN4OS/c1-11-5-6-13(10-15(11)18)22-12(2)16(20-21-22)17(23)19-8-7-14-4-3-9-24-14/h3-6,9-10H,7-8H2,1-2H3,(H,19,23)InChIKey
HWIYMPSZCMVSEL-UHFFFAOYSA-NSynonyms
1(3chloro4methylphenyl)5methylN(2(thiophen2yl)ethyl)1H123triazole4carboxamide
1(3chloro4methylphenyl)5methylN(2thiophen2ylethyl)triazole4carboxamide
CC1=C(C=C(C=C1)N2C(=C(N=N2)C(=O)NCCC3=CC=CS3)C)Cl
InChI=1SC17H17ClN4OSc1115613(1015(11)18)2212(2)16(202122)17(23)1987144392414h36910H78H212H3(H1923)
MFCD18183519
ZINC000051317832
ZINC51317832
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