2-[(3,4-dichlorophenyl)-methyl-amino]-N-(4-fluorophenyl)-6-nitro-4-oxidanylidene-1H-quinazoline-8-carboxamide

Systemtic Name: 2-[(3,4-dichlorophenyl)-methyl-amino]-N-(4-fluorophenyl)-6-nitro-4-oxidanylidene-1H-quinazoline-8-carboxamide Openeye Name: 2-(3,4-dichloro-N-methyl-anilino)-N-(4-fluorophenyl)-6-nitro-4-oxo-1H-quinazoline-8-carboxamide CAS Name: 2-(3,4-dichloro-N-methylanilino)-N-(4-fluorophenyl)-6-nitro-4-oxo-1H-quinazoline-8-carboxamide IUPAC Name: 2-(3,4-dichloro-N-methylanilino)-N-(4-fluorophenyl)-6-nitro-4-oxo-1H-quinazoline-8-carboxamide Traditional Name: 2-(3,4-dichloro-N-methyl-anilino)-N-(4-fluorophenyl)-4-keto-6-nitro-1H-quinazoline-8-carboxamide Formula: C22H14Cl2FN5O4 MolecularWeight: 502.282063

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC(=C(C=C1)Cl)Cl)C2=NC(=O)C3=CC(=CC(=C3N2)C(=O)NC4=CC=C(C=C4)F)[N+](=O)[O-]

Isomeric SMILES

CN(C1=CC(=C(C=C1)Cl)Cl)C2=NC(=O)C3=CC(=CC(=C3N2)C(=O)NC4=CC=C(C=C4)F)[N+](=O)[O-]

InChI

InChI=1S/C22H14Cl2FN5O4/c1-29(13-6-7-17(23)18(24)10-13)22-27-19-15(20(31)26-12-4-2-11(25)3-5-12)8-14(30(33)34)9-16(19)21(32)28-22/h2-10H,1H3,(H,26,31)(H,27,28,32)