Vitas-M small molecule compound
{3-(furan-2-yl)-5-[(thiophen-2-ylmethyl)amino]-1H-1,2,4-triazol-1-yl}(3,4,5-trimethoxyphenyl)methanone
Catalog ID
STK825328
SMILES COc1cc(cc(c1OC)OC)C(=O)n1nc(nc1NCc1cccs1)c1ccco1
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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 C21H20N4O5S MW 440.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O5S/c1-27-16-10-13(11-17(28-2)18(16)29-3)20(26)25-21(22-12-14-6-5-9-31-14)23-19(24-25)15-7-4-8-30-15/h4-11H,12H2,1-3H3,(H,22,23,24)InChIKey
HKHIRSCZKHHLBJ-UHFFFAOYSA-NSynonyms
847847-54-5(3(furan2yl)5((thiophen2ylmethyl)amino)1H124triazol1yl)(345trimethoxyphenyl)methanone
(3(FURAN2YL)5(THIOPHEN2YLMETHYLAMINO)124TRIAZOL1YL)(345TRIMETHOXYPHENYL)METHANONE
847847545
COC1=CC(=CC(=C1OC)OC)C(=O)N2C(=NC(=N2)C3=CC=CO3)NCC4=CC=CS4
InChI=1SC21H20N4O5Sc127161013(1117(282)18(16)293)20(26)2521(2212146593114)2319(2425)157483015h411H12H213H3(H222324)
MFCD07393318
ZINC000009130074
ZINC09130074
ZINC9130074
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