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

Systemtic Name: 1-[3,5-bis(bromanyl)-4-(4-oxidanyl-3-propan-2-yl-phenoxy)phenyl]-4-(pyridin-3-ylamino)butan-2-one Openeye Name: 1-[3,5-dibromo-4-(4-hydroxy-3-isopropyl-phenoxy)phenyl]-4-(3-pyridylamino)butan-2-one CAS Name: 1-[3,5-dibromo-4-(4-hydroxy-3-propan-2-ylphenoxy)phenyl]-4-(3-pyridinylamino)-2-butanone IUPAC Name: 1-[3,5-dibromo-4-(4-hydroxy-3-propan-2-ylphenoxy)phenyl]-4-(pyridin-3-ylamino)butan-2-one Traditional Name: 1-[3,5-dibromo-4-(4-hydroxy-3-isopropyl-phenoxy)phenyl]-4-(3-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=CN=CC=C3)Br)O

Isomeric SMILES

CC(C)C1=C(C=CC(=C1)OC2=C(C=C(C=C2Br)CC(=O)CCNC3=CN=CC=C3)Br)O

InChI

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