Vitas-M small molecule compound

1-(4-bromo-3-methylphenyl)-N-cyclopentyl-5-methyl-1H-1,2,3-triazole-4-carboxamide

Catalog ID
STK986640
SMILES O=C(c1nnn(c1C)c1ccc(c(c1)C)Br)NC1CCCC1

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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 C16H19BrN4O MW 363.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19BrN4O/c1-10-9-13(7-8-14(10)17)21-11(2)15(19-20-21)16(22)18-12-5-3-4-6-12/h7-9,12H,3-6H2,1-2H3,(H,18,22)
InChIKey
MYWWZZBYTDLXKF-UHFFFAOYSA-N
Synonyms

1(4bromo3methylphenyl)Ncyclopentyl5methyl1H123triazole4carboxamide
1(4bromo3methylphenyl)Ncyclopentyl5methyltriazole4carboxamide
CC1=C(C=CC(=C1)N2C(=C(N=N2)C(=O)NC3CCCC3)C)Br
InChI=1SC16H19BrN4Oc110913(7814(10)17)2111(2)15(192021)16(22)1812534612h7912H36H212H3(H1822)
MFCD18183535
ZINC000051317866
ZINC51317866

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Available files

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