Vitas-M small molecule compound
6-(3-ethoxy-4-methoxyphenyl)-3-(propylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Catalog ID
STL169884
SMILES CCCSc1nnc2c(n1)OC(Nc1c2cccc1)c1ccc(c(c1)OCC)OC
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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 C22H24N4O3S MW 424.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N4O3S/c1-4-12-30-22-24-21-19(25-26-22)15-8-6-7-9-16(15)23-20(29-21)14-10-11-17(27-3)18(13-14)28-5-2/h6-11,13,20,23H,4-5,12H2,1-3H3InChIKey
JBRLZDWIGQPFPX-UHFFFAOYSA-NSynonyms
6(3ethoxy4methoxyphenyl)3(propylsulfanyl)67dihydro(124)triazino(56d)(31)benzoxazepine
6(3ETHOXY4METHOXYPHENYL)3PROPYLSULFANYL67DIHYDRO(124)TRIAZINO(56D)(31)BENZOXAZEPINE
CCCSC1=NC2=C(C3=CC=CC=C3NC(O2)C4=CC(=C(C=C4)OC)OCC)N=N1
InChI=1SC22H24N4O3Sc14123022242119(252622)15867916(15)2320(2921)14101117(273)18(1314)2852h611132023H4512H213H3
MFCD01835054
ZINC000002085471
ZINC000002085472
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