6,8-bis(bromanyl)-7-methyl-3-(morpholin-4-ylmethyl)-3-phenylsulfanyl-2H-chromen-4-one

Systemtic Name: 6,8-bis(bromanyl)-7-methyl-3-(morpholin-4-ylmethyl)-3-phenylsulfanyl-2H-chromen-4-one Openeye Name: 6,8-dibromo-7-methyl-3-(morpholinomethyl)-3-phenylsulfanyl-chroman-4-one CAS Name: 6,8-dibromo-7-methyl-3-(4-morpholinylmethyl)-3-(phenylthio)-3,4-dihydro-2H-1-benzopyran-4-one IUPAC Name: 6,8-dibromo-7-methyl-3-(morpholin-4-ylmethyl)-3-phenylsulfanyl-2H-chromen-4-one Traditional Name: 6,8-dibromo-7-methyl-3-(morpholinomethyl)-3-(phenylthio)chroman-4-one Formula: C21H21Br2NO3S MolecularWeight: 527.26934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1Br)OCC(C2=O)(CN3CCOCC3)SC4=CC=CC=C4)Br

Isomeric SMILES

CC1=C(C=C2C(=C1Br)OCC(C2=O)(CN3CCOCC3)SC4=CC=CC=C4)Br

InChI

InChI=1S/C21H21Br2NO3S/c1-14-17(22)11-16-19(18(14)23)27-13-21(20(16)25,12-24-7-9-26-10-8-24)28-15-5-3-2-4-6-15/h2-6,11H,7-10,12-13H2,1H3