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

Systemtic Name: 3-(1-adamantyl)-1-[1-[3-(3,4-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]-1-phenethyl-urea Openeye Name: 3-(1-adamantyl)-1-[1-[3-(3,4-dimethylphenyl)-4-oxo-quinazolin-2-yl]propyl]-1-phenethyl-urea CAS Name: 3-(1-adamantyl)-1-[1-[3-(3,4-dimethylphenyl)-4-oxo-2-quinazolinyl]propyl]-1-phenethylurea IUPAC Name: 3-(1-adamantyl)-1-[1-[3-(3,4-dimethylphenyl)-4-oxoquinazolin-2-yl]propyl]-1-phenethylurea Traditional Name: 3-(1-adamantyl)-1-[1-[3-(3,4-dimethylphenyl)-4-keto-quinazolin-2-yl]propyl]-1-phenethyl-urea Formula: C38H44N4O2 MolecularWeight: 588.78156

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=CC=CC=C2C(=O)N1C3=CC(=C(C=C3)C)C)N(CCC4=CC=CC=C4)C(=O)NC56CC7CC(C5)CC(C7)C6

Isomeric SMILES

CCC(C1=NC2=CC=CC=C2C(=O)N1C3=CC(=C(C=C3)C)C)N(CCC4=CC=CC=C4)C(=O)NC56CC7CC(C5)CC(C7)C6

InChI

InChI=1S/C38H44N4O2/c1-4-34(35-39-33-13-9-8-12-32(33)36(43)42(35)31-15-14-25(2)26(3)18-31)41(17-16-27-10-6-5-7-11-27)37(44)40-38-22-28-19-29(23-38)21-30(20-28)24-38/h5-15,18,28-30,34H,4,16-17,19-24H2,1-3H3,(H,40,44)