3-(1-adamantyl)-1-[1-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)propyl]-1-(phenylmethyl)urea

Systemtic Name: 3-(1-adamantyl)-1-[1-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)propyl]-1-(phenylmethyl)urea Openeye Name: 3-(1-adamantyl)-1-benzyl-1-[1-(4-oxo-3-phenyl-quinazolin-2-yl)propyl]urea CAS Name: 3-(1-adamantyl)-1-[1-(4-oxo-3-phenyl-2-quinazolinyl)propyl]-1-(phenylmethyl)urea IUPAC Name: 3-(1-adamantyl)-1-benzyl-1-[1-(4-oxo-3-phenylquinazolin-2-yl)propyl]urea Traditional Name: 3-(1-adamantyl)-1-benzyl-1-[1-(4-keto-3-phenyl-quinazolin-2-yl)propyl]urea Formula: C35H38N4O2 MolecularWeight: 546.70182

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3)N(CC4=CC=CC=C4)C(=O)NC56CC7CC(C5)CC(C7)C6

Isomeric SMILES

CCC(C1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3)N(CC4=CC=CC=C4)C(=O)NC56CC7CC(C5)CC(C7)C6

InChI

InChI=1S/C35H38N4O2/c1-2-31(32-36-30-16-10-9-15-29(30)33(40)39(32)28-13-7-4-8-14-28)38(23-24-11-5-3-6-12-24)34(41)37-35-20-25-17-26(21-35)19-27(18-25)22-35/h3-16,25-27,31H,2,17-23H2,1H3,(H,37,41)