Vitas-M small molecule compound
1-{5-[(2-methoxybenzyl)amino]-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl}-3-methylbutan-1-one
Catalog ID
STK227705
SMILES COc1ccccc1CNc1nc(nn1C(=O)CC(C)C)c1cccnc1
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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 C20H23N5O2 MW 365.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N5O2/c1-14(2)11-18(26)25-20(22-13-15-7-4-5-9-17(15)27-3)23-19(24-25)16-8-6-10-21-12-16/h4-10,12,14H,11,13H2,1-3H3,(H,22,23,24)InChIKey
VHRUGHYMIIYUED-UHFFFAOYSA-NSynonyms
1(5((2METHOXYBENZYL)AMINO)3(PYRIDIN3YL)1H124TRIAZOL1YL)3METHYLBUTAN1ONE
1(5((2METHOXYPHENYL)METHYLAMINO)3PYRIDIN3YL124TRIAZOL1YL)3METHYLBUTAN1ONE
CC(C)CC(=O)N1C(=NC(=N1)C2=CN=CC=C2)NCC3=CC=CC=C3OC
InChI=1SC20H23N5O2c114(2)1118(26)2520(221315745917(15)273)2319(2425)168610211216h4101214H1113H213H3(H222324)
MFCD08671785
ZINC000004732574
ZINC04732574
ZINC4732574
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