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

Systemtic Name: 1-[1-[3-(3,4-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]-1-phenethyl-3-(phenylmethyl)urea Openeye Name: 3-benzyl-1-[1-[3-(3,4-dimethylphenyl)-4-oxo-quinazolin-2-yl]propyl]-1-phenethyl-urea CAS Name: 1-[1-[3-(3,4-dimethylphenyl)-4-oxo-2-quinazolinyl]propyl]-1-phenethyl-3-(phenylmethyl)urea IUPAC Name: 3-benzyl-1-[1-[3-(3,4-dimethylphenyl)-4-oxoquinazolin-2-yl]propyl]-1-phenethylurea Traditional Name: 3-benzyl-1-[1-[3-(3,4-dimethylphenyl)-4-keto-quinazolin-2-yl]propyl]-1-phenethyl-urea Formula: C35H36N4O2 MolecularWeight: 544.68594

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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)NCC5=CC=CC=C5

Isomeric SMILES

CCC(C1=NC2=CC=CC=C2C(=O)N1C3=CC(=C(C=C3)C)C)N(CCC4=CC=CC=C4)C(=O)NCC5=CC=CC=C5

InChI

InChI=1S/C35H36N4O2/c1-4-32(38(22-21-27-13-7-5-8-14-27)35(41)36-24-28-15-9-6-10-16-28)33-37-31-18-12-11-17-30(31)34(40)39(33)29-20-19-25(2)26(3)23-29/h5-20,23,32H,4,21-22,24H2,1-3H3,(H,36,41)