Vitas-M small molecule compound
1-{2-[(4-chlorophenyl)amino]-2-oxoethyl}-N-(3-methylphenyl)-5-[(4-methylphenyl)amino]-1H-1,2,3-triazole-4-carboxamide
Catalog ID
STL081236
SMILES O=C(Cn1nnc(c1Nc1ccc(cc1)C)C(=O)Nc1cccc(c1)C)Nc1ccc(cc1)Cl
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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 C25H23ClN6O2 MW 474.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23ClN6O2/c1-16-6-10-20(11-7-16)28-24-23(25(34)29-21-5-3-4-17(2)14-21)30-31-32(24)15-22(33)27-19-12-8-18(26)9-13-19/h3-14,28H,15H2,1-2H3,(H,27,33)(H,29,34)InChIKey
AHLCHWVWULGUKJ-UHFFFAOYSA-NSynonyms
1(2((4chlorophenyl)amino)2oxoethyl)N(3methylphenyl)5((4methylphenyl)amino)1H123triazole4carboxamide
1(2(4chloroanilino)2oxoethyl)5(4methylanilino)N(3methylphenyl)triazole4carboxamide
CC1=CC=C(C=C1)NC2=C(N=NN2CC(=O)NC3=CC=C(C=C3)Cl)C(=O)NC4=CC=CC(=C4)C
InChI=1SC25H23ClN6O2c11661020(11716)282423(25(34)292153417(2)1421)303132(24)1522(33)271912818(26)91319h31428H15H212H3(H2733)(H2934)
MFCD18201663
ZINC000067225310
ZINC67225310
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