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

Systemtic Name: 3-(1-adamantyl)-1-[1-[3-(2,4-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-1-hexyl-urea Openeye Name: 3-(1-adamantyl)-1-[1-[3-(2,4-dimethylphenyl)-4-oxo-quinazolin-2-yl]ethyl]-1-hexyl-urea CAS Name: 3-(1-adamantyl)-1-[1-[3-(2,4-dimethylphenyl)-4-oxo-2-quinazolinyl]ethyl]-1-hexylurea IUPAC Name: 3-(1-adamantyl)-1-[1-[3-(2,4-dimethylphenyl)-4-oxoquinazolin-2-yl]ethyl]-1-hexylurea Traditional Name: 3-(1-adamantyl)-1-[1-[3-(2,4-dimethylphenyl)-4-keto-quinazolin-2-yl]ethyl]-1-hexyl-urea Formula: C35H46N4O2 MolecularWeight: 554.76534

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C35H46N4O2/c1-5-6-7-10-15-38(34(41)37-35-20-26-17-27(21-35)19-28(18-26)22-35)25(4)32-36-30-12-9-8-11-29(30)33(40)39(32)31-14-13-23(2)16-24(31)3/h8-9,11-14,16,25-28H,5-7,10,15,17-22H2,1-4H3,(H,37,41)