Vitas-M small molecule compound

1-(3-chloro-4-methylphenyl)-5-methyl-N-[3-(propan-2-yloxy)propyl]-1H-1,2,3-triazole-4-carboxamide

Catalog ID
STK986631
SMILES CC(OCCCNC(=O)c1nnn(c1C)c1ccc(c(c1)Cl)C)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 C17H23ClN4O2 MW 350.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H23ClN4O2/c1-11(2)24-9-5-8-19-17(23)16-13(4)22(21-20-16)14-7-6-12(3)15(18)10-14/h6-7,10-11H,5,8-9H2,1-4H3,(H,19,23)
InChIKey
YWUOQRBPUSUHDD-UHFFFAOYSA-N
Synonyms

1(3chloro4methylphenyl)5methylN(3(propan2yloxy)propyl)1H123triazole4carboxamide
1(3chloro4methylphenyl)5methylN(3propan2yloxypropyl)triazole4carboxamide
CC1=C(C=C(C=C1)N2C(=C(N=N2)C(=O)NCCCOC(C)C)C)Cl
InChI=1SC17H23ClN4O2c111(2)249581917(23)1613(4)22(212016)147612(3)15(18)1014h671011H589H214H3(H1923)
MFCD18183526
ZINC000051317847
ZINC51317847

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.