Vitas-M small molecule compound

N-(2,4-dimethylphenyl)-1-{2-[(2,5-dimethylphenyl)amino]-2-oxoethyl}-5-methyl-1H-1,2,3-triazole-4-carboxamide

Catalog ID
STL142964
SMILES Cc1ccc(c(c1)C)NC(=O)c1nnn(c1C)CC(=O)Nc1cc(C)ccc1C

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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 C22H25N5O2 MW 391.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N5O2/c1-13-7-9-18(16(4)10-13)24-22(29)21-17(5)27(26-25-21)12-20(28)23-19-11-14(2)6-8-15(19)3/h6-11H,12H2,1-5H3,(H,23,28)(H,24,29)
InChIKey
WAOBVVUIJWDMSQ-UHFFFAOYSA-N
Synonyms

1(2(25dimethylanilino)2oxoethyl)N(24dimethylphenyl)5methyltriazole4carboxamide
CC1=CC(=C(C=C1)NC(=O)C2=C(N(N=N2)CC(=O)NC3=C(C=CC(=C3)C)C)C)C
InChI=1SC22H25N5O2c1137918(16(4)1013)2422(29)2117(5)27(262521)1220(28)23191114(2)6815(19)3h611H12H215H3(H2328)(H2429)
MFCD20747753
N(24dimethylphenyl)1(2((25dimethylphenyl)amino)2oxoethyl)5methyl1H123triazole4carboxamide
ZINC000071327305
ZINC71327305

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Available files

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