1-butyl-3-(3-cyanophenyl)-1-[1-[4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]propyl]urea

Systemtic Name: 1-butyl-3-(3-cyanophenyl)-1-[1-[4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]propyl]urea Openeye Name: 1-[1-(3-benzyl-4-oxo-quinazolin-2-yl)propyl]-1-butyl-3-(3-cyanophenyl)urea CAS Name: 1-butyl-3-(3-cyanophenyl)-1-[1-[4-oxo-3-(phenylmethyl)-2-quinazolinyl]propyl]urea IUPAC Name: 1-[1-(3-benzyl-4-oxoquinazolin-2-yl)propyl]-1-butyl-3-(3-cyanophenyl)urea Traditional Name: 1-[1-(3-benzyl-4-keto-quinazolin-2-yl)propyl]-1-butyl-3-(3-cyanophenyl)urea Formula: C30H31N5O2 MolecularWeight: 493.59944

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C(CC)C1=NC2=CC=CC=C2C(=O)N1CC3=CC=CC=C3)C(=O)NC4=CC=CC(=C4)C#N

Isomeric SMILES

CCCCN(C(CC)C1=NC2=CC=CC=C2C(=O)N1CC3=CC=CC=C3)C(=O)NC4=CC=CC(=C4)C#N

InChI

InChI=1S/C30H31N5O2/c1-3-5-18-34(30(37)32-24-15-11-14-23(19-24)20-31)27(4-2)28-33-26-17-10-9-16-25(26)29(36)35(28)21-22-12-7-6-8-13-22/h6-17,19,27H,3-5,18,21H2,1-2H3,(H,32,37)