1-butyl-3-(3-chlorophenyl)-1-[1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl]urea

Systemtic Name: 1-butyl-3-(3-chlorophenyl)-1-[1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl]urea Openeye Name: 1-butyl-3-(3-chlorophenyl)-1-[1-(4-oxo-1H-quinazolin-2-yl)ethyl]urea CAS Name: 1-butyl-3-(3-chlorophenyl)-1-[1-(4-oxo-1H-quinazolin-2-yl)ethyl]urea IUPAC Name: 1-butyl-3-(3-chlorophenyl)-1-[1-(4-oxo-1H-quinazolin-2-yl)ethyl]urea Traditional Name: 1-butyl-3-(3-chlorophenyl)-1-[1-(4-keto-1H-quinazolin-2-yl)ethyl]urea Formula: C21H23ClN4O2 MolecularWeight: 398.88592

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C(C)C1=NC(=O)C2=CC=CC=C2N1)C(=O)NC3=CC(=CC=C3)Cl

Isomeric SMILES

CCCCN(C(C)C1=NC(=O)C2=CC=CC=C2N1)C(=O)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H23ClN4O2/c1-3-4-12-26(21(28)23-16-9-7-8-15(22)13-16)14(2)19-24-18-11-6-5-10-17(18)20(27)25-19/h5-11,13-14H,3-4,12H2,1-2H3,(H,23,28)(H,24,25,27)