3-[2-(1-adamantylcarbonyl)-3-phenyl-3,4-dihydropyrazol-5-yl]-6-bromanyl-4-phenyl-3H-quinolin-2-one

Systemtic Name: 3-[2-(1-adamantylcarbonyl)-3-phenyl-3,4-dihydropyrazol-5-yl]-6-bromanyl-4-phenyl-3H-quinolin-2-one Openeye Name: 3-[2-(adamantane-1-carbonyl)-3-phenyl-3,4-dihydropyrazol-5-yl]-6-bromo-4-phenyl-3H-quinolin-2-one CAS Name: 3-[2-[1-adamantyl(oxo)methyl]-3-phenyl-3,4-dihydropyrazol-5-yl]-6-bromo-4-phenyl-3H-quinolin-2-one IUPAC Name: 3-[2-(adamantane-1-carbonyl)-3-phenyl-3,4-dihydropyrazol-5-yl]-6-bromo-4-phenyl-3H-quinolin-2-one Traditional Name: 3-[1-(adamantane-1-carbonyl)-5-phenyl-2-pyrazolin-3-yl]-6-bromo-4-phenyl-3H-quinolin-2-one Formula: C35H32BrN3O2 MolecularWeight: 606.55148

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)N4C(CC(=N4)C5C(=C6C=C(C=CC6=NC5=O)Br)C7=CC=CC=C7)C8=CC=CC=C8

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)N4C(CC(=N4)C5C(=C6C=C(C=CC6=NC5=O)Br)C7=CC=CC=C7)C8=CC=CC=C8

InChI

InChI=1S/C35H32BrN3O2/c36-26-11-12-28-27(16-26)31(25-9-5-2-6-10-25)32(33(40)37-28)29-17-30(24-7-3-1-4-8-24)39(38-29)34(41)35-18-21-13-22(19-35)15-23(14-21)20-35/h1-12,16,21-23,30,32H,13-15,17-20H2