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

Systemtic Name: 3-(1-adamantyl)-1-butyl-1-[1-(4-oxidanylidene-3-propyl-quinazolin-2-yl)ethyl]urea Openeye Name: 3-(1-adamantyl)-1-butyl-1-[1-(4-oxo-3-propyl-quinazolin-2-yl)ethyl]urea CAS Name: 3-(1-adamantyl)-1-butyl-1-[1-(4-oxo-3-propyl-2-quinazolinyl)ethyl]urea IUPAC Name: 3-(1-adamantyl)-1-butyl-1-[1-(4-oxo-3-propylquinazolin-2-yl)ethyl]urea Traditional Name: 3-(1-adamantyl)-1-butyl-1-[1-(4-keto-3-propyl-quinazolin-2-yl)ethyl]urea Formula: C28H40N4O2 MolecularWeight: 464.6428

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C(C)C1=NC2=CC=CC=C2C(=O)N1CCC)C(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCCCN(C(C)C1=NC2=CC=CC=C2C(=O)N1CCC)C(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C28H40N4O2/c1-4-6-12-31(27(34)30-28-16-20-13-21(17-28)15-22(14-20)18-28)19(3)25-29-24-10-8-7-9-23(24)26(33)32(25)11-5-2/h7-10,19-22H,4-6,11-18H2,1-3H3,(H,30,34)