Vitas-M small molecule compound
1-{3,5-bis[(4-methylbenzyl)amino]-1H-1,2,4-triazol-1-yl}ethanone
Catalog ID
STK169897
SMILES Cc1ccc(cc1)CNc1nc(n(n1)C(=O)C)NCc1ccc(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 C20H23N5O MW 349.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N5O/c1-14-4-8-17(9-5-14)12-21-19-23-20(25(24-19)16(3)26)22-13-18-10-6-15(2)7-11-18/h4-11H,12-13H2,1-3H3,(H2,21,22,23,24)InChIKey
JOAAZTYVPKUPNC-UHFFFAOYSA-NSynonyms
860606-43-51(35BIS((4METHYLBENZYL)AMINO)1H124TRIAZOL1YL)ETHANONE
1(35BIS((4METHYLPHENYL)METHYLAMINO)124TRIAZOL1YL)ETHANONE
860606435
CC1=CC=C(C=C1)CNC2=NN(C(=N2)NCC3=CC=C(C=C3)C)C(=O)C
InChI=1SC20H23N5Oc1144817(9514)1221192320(25(2419)16(3)26)22131810615(2)71118h411H1213H213H3(H221222324)
MFCD06663415
ZINC000004703237
ZINC04703237
ZINC4703237
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