Vitas-M small molecule compound
1-{2-[(3-chloro-4-methylphenyl)amino]-2-oxoethyl}-N-(4-methoxyphenyl)-5-methyl-1H-1,2,3-triazole-4-carboxamide
Catalog ID
STL129815
SMILES COc1ccc(cc1)NC(=O)c1nnn(c1C)CC(=O)Nc1ccc(c(c1)Cl)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 C20H20ClN5O3 MW 413.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20ClN5O3/c1-12-4-5-15(10-17(12)21)22-18(27)11-26-13(2)19(24-25-26)20(28)23-14-6-8-16(29-3)9-7-14/h4-10H,11H2,1-3H3,(H,22,27)(H,23,28)InChIKey
AMDRUAIFBRUFGT-UHFFFAOYSA-NSynonyms
1(2((3chloro4methylphenyl)amino)2oxoethyl)N(4methoxyphenyl)5methyl1H123triazole4carboxamide
1(2(3chloro4methylanilino)2oxoethyl)N(4methoxyphenyl)5methyltriazole4carboxamide
CC1=C(C=C(C=C1)NC(=O)CN2C(=C(N=N2)C(=O)NC3=CC=C(C=C3)OC)C)Cl
InChI=1SC20H20ClN5O3c1124515(1017(12)21)2218(27)112613(2)19(242526)20(28)23146816(293)9714h410H11H213H3(H2227)(H2328)
MFCD20747924
ZINC000067323031
ZINC67323031
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