1-[3,5-bis(bromanyl)-4-(4-oxidanyl-3-propan-2-yl-phenoxy)phenyl]-4-(pyridin-2-ylamino)butan-2-one

Systemtic Name: 1-[3,5-bis(bromanyl)-4-(4-oxidanyl-3-propan-2-yl-phenoxy)phenyl]-4-(pyridin-2-ylamino)butan-2-one Openeye Name: 1-[3,5-dibromo-4-(4-hydroxy-3-isopropyl-phenoxy)phenyl]-4-(2-pyridylamino)butan-2-one CAS Name: 1-[3,5-dibromo-4-(4-hydroxy-3-propan-2-ylphenoxy)phenyl]-4-(2-pyridinylamino)-2-butanone IUPAC Name: 1-[3,5-dibromo-4-(4-hydroxy-3-propan-2-ylphenoxy)phenyl]-4-(pyridin-2-ylamino)butan-2-one Traditional Name: 1-[3,5-dibromo-4-(4-hydroxy-3-isopropyl-phenoxy)phenyl]-4-(2-pyridylamino)butan-2-one Formula: C24H24Br2N2O3 MolecularWeight: 548.26696

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=CC(=C1)OC2=C(C=C(C=C2Br)CC(=O)CCNC3=CC=CC=N3)Br)O

Isomeric SMILES

CC(C)C1=C(C=CC(=C1)OC2=C(C=C(C=C2Br)CC(=O)CCNC3=CC=CC=N3)Br)O

InChI

InChI=1S/C24H24Br2N2O3/c1-15(2)19-14-18(6-7-22(19)30)31-24-20(25)12-16(13-21(24)26)11-17(29)8-10-28-23-5-3-4-9-27-23/h3-7,9,12-15,30H,8,10-11H2,1-2H3,(H,27,28)