Vitas-M small molecule compound
1-{3,5-bis[(4-ethylbenzyl)amino]-1H-1,2,4-triazol-1-yl}-2-methoxyethanone
Catalog ID
STK169914
SMILES COCC(=O)n1nc(nc1NCc1ccc(cc1)CC)NCc1ccc(cc1)CC
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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 C23H29N5O2 MW 407.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29N5O2/c1-4-17-6-10-19(11-7-17)14-24-22-26-23(28(27-22)21(29)16-30-3)25-15-20-12-8-18(5-2)9-13-20/h6-13H,4-5,14-16H2,1-3H3,(H2,24,25,26,27)InChIKey
KQQVFPGAQCPXAX-UHFFFAOYSA-NSynonyms
1(35BIS((4ETHYLBENZYL)AMINO)1H124TRIAZOL1YL)2METHOXYETHANONE
1(35BIS((4ETHYLPHENYL)METHYLAMINO)124TRIAZOL1YL)2METHOXYETHANONE
CCC1=CC=C(C=C1)CNC2=NN(C(=N2)NCC3=CC=C(C=C3)CC)C(=O)COC
InChI=1SC23H29N5O2c141761019(11717)1424222623(28(2722)21(29)16303)25152012818(52)91320h613H451416H213H3(H224252627)
MFCD06663430
ZINC000004703244
ZINC04703244
ZINC4703244
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Check stock on Vitas-MAvailable files
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