Vitas-M small molecule compound
1-(3-chloro-4-methylphenyl)-5-methyl-N-(4-phenylbutan-2-yl)-1H-1,2,3-triazole-4-carboxamide
Catalog ID
STK986625
SMILES CC(NC(=O)c1nnn(c1C)c1ccc(c(c1)Cl)C)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 C21H23ClN4O MW 382.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23ClN4O/c1-14-9-12-18(13-19(14)22)26-16(3)20(24-25-26)21(27)23-15(2)10-11-17-7-5-4-6-8-17/h4-9,12-13,15H,10-11H2,1-3H3,(H,23,27)InChIKey
GHVXJYLZUZDZEC-UHFFFAOYSA-NSynonyms
1(3chloro4methylphenyl)5methylN(4phenylbutan2yl)1H123triazole4carboxamide
1(3chloro4methylphenyl)5methylN(4phenylbutan2yl)triazole4carboxamide
CC1=C(C=C(C=C1)N2C(=C(N=N2)C(=O)NC(C)CCC3=CC=CC=C3)C)Cl
InChI=1SC21H23ClN4Oc11491218(1319(14)22)2616(3)20(242526)21(27)2315(2)1011177546817h49121315H1011H213H3(H2327)
MFCD18183520
ZINC000051317834
ZINC000051317835
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