3-(1-adamantyl)-1-butyl-1-[1-[3-(2,5-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]urea

Systemtic Name: 3-(1-adamantyl)-1-butyl-1-[1-[3-(2,5-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]urea Openeye Name: 3-(1-adamantyl)-1-butyl-1-[1-[3-(2,5-dimethylphenyl)-4-oxo-quinazolin-2-yl]ethyl]urea CAS Name: 3-(1-adamantyl)-1-butyl-1-[1-[3-(2,5-dimethylphenyl)-4-oxo-2-quinazolinyl]ethyl]urea IUPAC Name: 3-(1-adamantyl)-1-butyl-1-[1-[3-(2,5-dimethylphenyl)-4-oxoquinazolin-2-yl]ethyl]urea Traditional Name: 3-(1-adamantyl)-1-butyl-1-[1-[3-(2,5-dimethylphenyl)-4-keto-quinazolin-2-yl]ethyl]urea Formula: C33H42N4O2 MolecularWeight: 526.71218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C(C)C1=NC2=CC=CC=C2C(=O)N1C3=C(C=CC(=C3)C)C)C(=O)NC45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CCCCN(C(C)C1=NC2=CC=CC=C2C(=O)N1C3=C(C=CC(=C3)C)C)C(=O)NC45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C33H42N4O2/c1-5-6-13-36(32(39)35-33-18-24-15-25(19-33)17-26(16-24)20-33)23(4)30-34-28-10-8-7-9-27(28)31(38)37(30)29-14-21(2)11-12-22(29)3/h7-12,14,23-26H,5-6,13,15-20H2,1-4H3,(H,35,39)