1-methyl-1-[1-(3-methyl-4-oxidanylidene-quinazolin-2-yl)propyl]-3-[4-(trifluoromethyl)phenyl]urea

Systemtic Name: 1-methyl-1-[1-(3-methyl-4-oxidanylidene-quinazolin-2-yl)propyl]-3-[4-(trifluoromethyl)phenyl]urea Openeye Name: 1-methyl-1-[1-(3-methyl-4-oxo-quinazolin-2-yl)propyl]-3-[4-(trifluoromethyl)phenyl]urea CAS Name: 1-methyl-1-[1-(3-methyl-4-oxo-2-quinazolinyl)propyl]-3-[4-(trifluoromethyl)phenyl]urea IUPAC Name: 1-methyl-1-[1-(3-methyl-4-oxoquinazolin-2-yl)propyl]-3-[4-(trifluoromethyl)phenyl]urea Traditional Name: 1-[1-(4-keto-3-methyl-quinazolin-2-yl)propyl]-1-methyl-3-[4-(trifluoromethyl)phenyl]urea Formula: C21H21F3N4O2 MolecularWeight: 418.41225

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=CC=CC=C2C(=O)N1C)N(C)C(=O)NC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CCC(C1=NC2=CC=CC=C2C(=O)N1C)N(C)C(=O)NC3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C21H21F3N4O2/c1-4-17(18-26-16-8-6-5-7-15(16)19(29)28(18)3)27(2)20(30)25-14-11-9-13(10-12-14)21(22,23)24/h5-12,17H,4H2,1-3H3,(H,25,30)