1-[1-[3-(4-fluorophenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-1-methyl-3-(2-methyl-3-nitro-phenyl)urea

Systemtic Name: 1-[1-[3-(4-fluorophenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-1-methyl-3-(2-methyl-3-nitro-phenyl)urea Openeye Name: 1-[1-[3-(4-fluorophenyl)-4-oxo-quinazolin-2-yl]ethyl]-1-methyl-3-(2-methyl-3-nitro-phenyl)urea CAS Name: 1-[1-[3-(4-fluorophenyl)-4-oxo-2-quinazolinyl]ethyl]-1-methyl-3-(2-methyl-3-nitrophenyl)urea IUPAC Name: 1-[1-[3-(4-fluorophenyl)-4-oxoquinazolin-2-yl]ethyl]-1-methyl-3-(2-methyl-3-nitrophenyl)urea Traditional Name: 1-[1-[3-(4-fluorophenyl)-4-keto-quinazolin-2-yl]ethyl]-1-methyl-3-(2-methyl-3-nitro-phenyl)urea Formula: C25H22FN5O4 MolecularWeight: 475.471683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)N(C)C(C)C2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)F

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)N(C)C(C)C2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)F

InChI

InChI=1S/C25H22FN5O4/c1-15-20(9-6-10-22(15)31(34)35)28-25(33)29(3)16(2)23-27-21-8-5-4-7-19(21)24(32)30(23)18-13-11-17(26)12-14-18/h4-14,16H,1-3H3,(H,28,33)