Vitas-M small molecule compound
N-(5-chloro-2-methylphenyl)-1-{2-[(3,4-dimethylphenyl)amino]-2-oxoethyl}-5-methyl-1H-1,2,3-triazole-4-carboxamide
Catalog ID
STL129549
SMILES Clc1ccc(c(c1)NC(=O)c1nnn(c1C)CC(=O)Nc1ccc(c(c1)C)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 C21H22ClN5O2 MW 411.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22ClN5O2/c1-12-6-8-17(9-14(12)3)23-19(28)11-27-15(4)20(25-26-27)21(29)24-18-10-16(22)7-5-13(18)2/h5-10H,11H2,1-4H3,(H,23,28)(H,24,29)InChIKey
AYXSDWIIUYKDIF-UHFFFAOYSA-NSynonyms
CC1=C(C=C(C=C1)NC(=O)CN2C(=C(N=N2)C(=O)NC3=C(C=CC(=C3)Cl)C)C)C
InChI=1SC21H22ClN5O2c1126817(914(12)3)2319(28)112715(4)20(252627)21(29)24181016(22)7513(18)2h510H11H214H3(H2328)(H2429)
MFCD20747265
N(5chloro2methylphenyl)1(2((34dimethylphenyl)amino)2oxoethyl)5methyl1H123triazole4carboxamide
N(5chloro2methylphenyl)1(2(34dimethylanilino)2oxoethyl)5methyltriazole4carboxamide
ZINC000067322234
ZINC67322234
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