Vitas-M small molecule compound
5-amino-N-(2-methoxybenzyl)-1-{2-[(4-methylphenyl)amino]-2-oxoethyl}-1H-1,2,3-triazole-4-carboxamide
Catalog ID
STL081808
SMILES COc1ccccc1CNC(=O)c1nnn(c1N)CC(=O)Nc1ccc(cc1)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 C20H22N6O3 MW 394.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N6O3/c1-13-7-9-15(10-8-13)23-17(27)12-26-19(21)18(24-25-26)20(28)22-11-14-5-3-4-6-16(14)29-2/h3-10H,11-12,21H2,1-2H3,(H,22,28)(H,23,27)InChIKey
PTXQTXBRQUNFOC-UHFFFAOYSA-NSynonyms
5aminoN((2methoxyphenyl)methyl)1(2(4methylanilino)2oxoethyl)triazole4carboxamide
5aminoN(2methoxybenzyl)1(2((4methylphenyl)amino)2oxoethyl)1H123triazole4carboxamide
CC1=CC=C(C=C1)NC(=O)CN2C(=C(N=N2)C(=O)NCC3=CC=CC=C3OC)N
InChI=1SC20H22N6O3c1137915(10813)2317(27)122619(21)18(242526)20(28)221114534616(14)292h310H111221H212H3(H2228)(H2327)
MFCD14928025
ZINC000006999495
ZINC06999495
ZINC6999495
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