Vitas-M small molecule compound
N-(2-chlorobenzyl)-5-[(3,4-dimethylphenyl)amino]-1H-1,2,3-triazole-4-carboxamide
Catalog ID
STL098705
SMILES O=C(c1nn[nH]c1Nc1ccc(c(c1)C)C)NCc1ccccc1Cl
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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 C18H18ClN5O MW 355.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18ClN5O/c1-11-7-8-14(9-12(11)2)21-17-16(22-24-23-17)18(25)20-10-13-5-3-4-6-15(13)19/h3-9H,10H2,1-2H3,(H,20,25)(H2,21,22,23,24)InChIKey
ADIKGPLDCBTREF-UHFFFAOYSA-NSynonyms
CC1=C(C=C(C=C1)NC2=NNN=C2C(=O)NCC3=CC=CC=C3Cl)C
InChI=1SC18H18ClN5Oc1117814(912(11)2)211716(22242317)18(25)201013534615(13)19h39H10H212H3(H2025)(H221222324)
MFCD18789948
N((2chlorophenyl)methyl)5(34dimethylanilino)2Htriazole4carboxamide
N(2chlorobenzyl)5((34dimethylphenyl)amino)1H123triazole4carboxamide
O=C(c1nn(nH)c1Nc1ccc(c(c1)C)C)NCc1ccccc1Cl
ZINC000067283930
ZINC67283930
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