3-(1-adamantyl)-1-[1-[3-(3-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]-1-hexyl-urea

Systemtic Name: 3-(1-adamantyl)-1-[1-[3-(3-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]-1-hexyl-urea Openeye Name: 3-(1-adamantyl)-1-[1-[3-(3-chlorophenyl)-4-oxo-quinazolin-2-yl]propyl]-1-hexyl-urea CAS Name: 3-(1-adamantyl)-1-[1-[3-(3-chlorophenyl)-4-oxo-2-quinazolinyl]propyl]-1-hexylurea IUPAC Name: 3-(1-adamantyl)-1-[1-[3-(3-chlorophenyl)-4-oxoquinazolin-2-yl]propyl]-1-hexylurea Traditional Name: 3-(1-adamantyl)-1-[1-[3-(3-chlorophenyl)-4-keto-quinazolin-2-yl]propyl]-1-hexyl-urea Formula: C34H43ClN4O2 MolecularWeight: 575.18382

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C34H43ClN4O2/c1-3-5-6-9-15-38(33(41)37-34-20-23-16-24(21-34)18-25(17-23)22-34)30(4-2)31-36-29-14-8-7-13-28(29)32(40)39(31)27-12-10-11-26(35)19-27/h7-8,10-14,19,23-25,30H,3-6,9,15-18,20-22H2,1-2H3,(H,37,41)