1-butyl-3-tert-butyl-1-[1-[3-(3-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]urea

Systemtic Name: 1-butyl-3-tert-butyl-1-[1-[3-(3-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]urea Openeye Name: 1-butyl-3-tert-butyl-1-[1-[3-(3-chlorophenyl)-4-oxo-quinazolin-2-yl]propyl]urea CAS Name: 1-butyl-3-tert-butyl-1-[1-[3-(3-chlorophenyl)-4-oxo-2-quinazolinyl]propyl]urea IUPAC Name: 1-butyl-3-tert-butyl-1-[1-[3-(3-chlorophenyl)-4-oxoquinazolin-2-yl]propyl]urea Traditional Name: 1-butyl-3-tert-butyl-1-[1-[3-(3-chlorophenyl)-4-keto-quinazolin-2-yl]propyl]urea Formula: C26H33ClN4O2 MolecularWeight: 469.01882

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C(CC)C1=NC2=CC=CC=C2C(=O)N1C3=CC(=CC=C3)Cl)C(=O)NC(C)(C)C

Isomeric SMILES

CCCCN(C(CC)C1=NC2=CC=CC=C2C(=O)N1C3=CC(=CC=C3)Cl)C(=O)NC(C)(C)C

InChI

InChI=1S/C26H33ClN4O2/c1-6-8-16-30(25(33)29-26(3,4)5)22(7-2)23-28-21-15-10-9-14-20(21)24(32)31(23)19-13-11-12-18(27)17-19/h9-15,17,22H,6-8,16H2,1-5H3,(H,29,33)