2-cyclohexyl-N-[2-[(3,4-dichlorophenyl)amino]-6-nitro-4-oxidanylidene-1H-quinazolin-8-yl]ethanamide

Systemtic Name: 2-cyclohexyl-N-[2-[(3,4-dichlorophenyl)amino]-6-nitro-4-oxidanylidene-1H-quinazolin-8-yl]ethanamide Openeye Name: 2-cyclohexyl-N-[2-(3,4-dichloroanilino)-6-nitro-4-oxo-1H-quinazolin-8-yl]acetamide CAS Name: 2-cyclohexyl-N-[2-(3,4-dichloroanilino)-6-nitro-4-oxo-1H-quinazolin-8-yl]acetamide IUPAC Name: 2-cyclohexyl-N-[2-(3,4-dichloroanilino)-6-nitro-4-oxo-1H-quinazolin-8-yl]acetamide Traditional Name: 2-cyclohexyl-N-[2-(3,4-dichloroanilino)-4-keto-6-nitro-1H-quinazolin-8-yl]acetamide Formula: C22H21Cl2N5O4 MolecularWeight: 490.33924

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(=O)NC2=C3C(=CC(=C2)[N+](=O)[O-])C(=O)N=C(N3)NC4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

C1CCC(CC1)CC(=O)NC2=C3C(=CC(=C2)[N+](=O)[O-])C(=O)N=C(N3)NC4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C22H21Cl2N5O4/c23-16-7-6-13(9-17(16)24)25-22-27-20-15(21(31)28-22)10-14(29(32)33)11-18(20)26-19(30)8-12-4-2-1-3-5-12/h6-7,9-12H,1-5,8H2,(H,26,30)(H2,25,27,28,31)