Vitas-M small molecule compound

N-(cyclopropylmethyl)-1-(3,4-dimethylphenyl)-5-methyl-1H-1,2,3-triazole-4-carboxamide

Catalog ID
STK986840
SMILES O=C(c1nnn(c1C)c1ccc(c(c1)C)C)NCC1CC1

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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 C16H20N4O MW 284.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N4O/c1-10-4-7-14(8-11(10)2)20-12(3)15(18-19-20)16(21)17-9-13-5-6-13/h4,7-8,13H,5-6,9H2,1-3H3,(H,17,21)
InChIKey
IECPACJOCHFOBL-UHFFFAOYSA-N
Synonyms

CC1=C(C=C(C=C1)N2C(=C(N=N2)C(=O)NCC3CC3)C)C
InChI=1SC16H20N4Oc1104714(811(10)2)2012(3)15(181920)16(21)179135613h47813H569H213H3(H1721)
MFCD18183735
N(cyclopropylmethyl)1(34dimethylphenyl)5methyl1H123triazole4carboxamide
N(cyclopropylmethyl)1(34dimethylphenyl)5methyltriazole4carboxamide
ZINC000051318275
ZINC51318275

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Available files

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