N-[2-chloranyl-5-(2-methyl-4-oxidanylidene-quinazolin-3-yl)phenyl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[2-chloranyl-5-(2-methyl-4-oxidanylidene-quinazolin-3-yl)phenyl]-4-nitro-benzenesulfonamide Openeye Name: N-[2-chloro-5-(2-methyl-4-oxo-quinazolin-3-yl)phenyl]-4-nitro-benzenesulfonamide CAS Name: N-[2-chloro-5-(2-methyl-4-oxo-3-quinazolinyl)phenyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[2-chloro-5-(2-methyl-4-oxoquinazolin-3-yl)phenyl]-4-nitrobenzenesulfonamide Traditional Name: N-[2-chloro-5-(4-keto-2-methyl-quinazolin-3-yl)phenyl]-4-nitro-benzenesulfonamide Formula: C21H15ClN4O5S MolecularWeight: 470.8856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1C3=CC(=C(C=C3)Cl)NS(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1C3=CC(=C(C=C3)Cl)NS(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H15ClN4O5S/c1-13-23-19-5-3-2-4-17(19)21(27)25(13)15-8-11-18(22)20(12-15)24-32(30,31)16-9-6-14(7-10-16)26(28)29/h2-12,24H,1H3