N-[1-[3-(4-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-N-(2-methylpropyl)-3-nitro-benzamide

Systemtic Name: N-[1-[3-(4-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-N-(2-methylpropyl)-3-nitro-benzamide Openeye Name: N-[1-[3-(4-chlorophenyl)-4-oxo-quinazolin-2-yl]ethyl]-N-isobutyl-3-nitro-benzamide CAS Name: N-[1-[3-(4-chlorophenyl)-4-oxo-2-quinazolinyl]ethyl]-N-(2-methylpropyl)-3-nitrobenzamide IUPAC Name: N-[1-[3-(4-chlorophenyl)-4-oxoquinazolin-2-yl]ethyl]-N-(2-methylpropyl)-3-nitrobenzamide Traditional Name: N-[1-[3-(4-chlorophenyl)-4-keto-quinazolin-2-yl]ethyl]-N-isobutyl-3-nitro-benzamide Formula: C27H25ClN4O4 MolecularWeight: 504.9648

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H25ClN4O4/c1-17(2)16-30(26(33)19-7-6-8-22(15-19)32(35)36)18(3)25-29-24-10-5-4-9-23(24)27(34)31(25)21-13-11-20(28)12-14-21/h4-15,17-18H,16H2,1-3H3