1-(3-methylbutyl)-3-(4-nitrophenyl)-1-[1-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)ethyl]urea

Systemtic Name: 1-(3-methylbutyl)-3-(4-nitrophenyl)-1-[1-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)ethyl]urea Openeye Name: 1-isopentyl-3-(4-nitrophenyl)-1-[1-(4-oxo-3-phenyl-quinazolin-2-yl)ethyl]urea CAS Name: 1-(3-methylbutyl)-3-(4-nitrophenyl)-1-[1-(4-oxo-3-phenyl-2-quinazolinyl)ethyl]urea IUPAC Name: 1-(3-methylbutyl)-3-(4-nitrophenyl)-1-[1-(4-oxo-3-phenylquinazolin-2-yl)ethyl]urea Traditional Name: 1-isoamyl-1-[1-(4-keto-3-phenyl-quinazolin-2-yl)ethyl]-3-(4-nitrophenyl)urea Formula: C28H29N5O4 MolecularWeight: 499.56096

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(C(C)C1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC(C)CCN(C(C)C1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C28H29N5O4/c1-19(2)17-18-31(28(35)29-21-13-15-23(16-14-21)33(36)37)20(3)26-30-25-12-8-7-11-24(25)27(34)32(26)22-9-5-4-6-10-22/h4-16,19-20H,17-18H2,1-3H3,(H,29,35)