1-cyclohexylurea; 2-[1-(3,4-dimethylphenyl)ethyl]-3-(phenylmethyl)quinazolin-4-one

Systemtic Name: 1-cyclohexylurea; 2-[1-(3,4-dimethylphenyl)ethyl]-3-(phenylmethyl)quinazolin-4-one Openeye Name: 3-benzyl-2-[1-(3,4-dimethylphenyl)ethyl]quinazolin-4-one; cyclohexylurea CAS Name: cyclohexylurea; 2-[1-(3,4-dimethylphenyl)ethyl]-3-(phenylmethyl)-4-quinazolinone IUPAC Name: 3-benzyl-2-[1-(3,4-dimethylphenyl)ethyl]quinazolin-4-one; cyclohexylurea Traditional Name: 3-benzyl-2-[1-(3,4-dimethylphenyl)ethyl]quinazolin-4-one; cyclohexylurea Formula: C32H38N4O2 MolecularWeight: 510.66972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)C2=NC3=CC=CC=C3C(=O)N2CC4=CC=CC=C4)C.C1CCC(CC1)NC(=O)N

Isomeric SMILES

CC1=C(C=C(C=C1)C(C)C2=NC3=CC=CC=C3C(=O)N2CC4=CC=CC=C4)C.C1CCC(CC1)NC(=O)N

InChI

InChI=1S/C25H24N2O.C7H14N2O/c1-17-13-14-21(15-18(17)2)19(3)24-26-23-12-8-7-11-22(23)25(28)27(24)16-20-9-5-4-6-10-20;8-7(10)9-6-4-2-1-3-5-6/h4-15,19H,16H2,1-3H3;6H,1-5H2,(H3,8,9,10)