Vitas-M small molecule compound
3-(ethylsulfanyl)-6-(3-phenoxyphenyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Catalog ID
STK980120
SMILES CCSc1nnc2c(n1)OC(Nc1c2cccc1)c1cccc(c1)Oc1ccccc1
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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 C24H20N4O2S MW 428.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20N4O2S/c1-2-31-24-26-23-21(27-28-24)19-13-6-7-14-20(19)25-22(30-23)16-9-8-12-18(15-16)29-17-10-4-3-5-11-17/h3-15,22,25H,2H2,1H3InChIKey
MXBPSSYNRMLSGM-UHFFFAOYSA-NSynonyms
353472-83-03(ethylsulfanyl)6(3phenoxyphenyl)67dihydro(124)triazino(56d)(31)benzoxazepine
353472830
3ETHYLSULFANYL6(3PHENOXYPHENYL)67DIHYDRO(124)TRIAZINO(56D)(31)BENZOXAZEPINE
CCSC1=NC2=C(C3=CC=CC=C3NC(O2)C4=CC(=CC=C4)OC5=CC=CC=C5)N=N1
InChI=1SC24H20N4O2Sc123124262321(272824)1913671420(19)2522(3023)16981218(1516)2917104351117h3152225H2H21H3
MFCD01417360
ZINC000002081443
ZINC000002081444
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