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

Systemtic Name: 3-(1-adamantyl)-1-butyl-1-[1-[3-(3-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]urea Openeye Name: 3-(1-adamantyl)-1-butyl-1-[1-[3-(3-chlorophenyl)-4-oxo-quinazolin-2-yl]ethyl]urea CAS Name: 3-(1-adamantyl)-1-butyl-1-[1-[3-(3-chlorophenyl)-4-oxo-2-quinazolinyl]ethyl]urea IUPAC Name: 3-(1-adamantyl)-1-butyl-1-[1-[3-(3-chlorophenyl)-4-oxoquinazolin-2-yl]ethyl]urea Traditional Name: 3-(1-adamantyl)-1-butyl-1-[1-[3-(3-chlorophenyl)-4-keto-quinazolin-2-yl]ethyl]urea Formula: C31H37ClN4O2 MolecularWeight: 533.10408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H37ClN4O2/c1-3-4-12-35(30(38)34-31-17-21-13-22(18-31)15-23(14-21)19-31)20(2)28-33-27-11-6-5-10-26(27)29(37)36(28)25-9-7-8-24(32)16-25/h5-11,16,20-23H,3-4,12-15,17-19H2,1-2H3,(H,34,38)