3-(2-chlorophenyl)-2-(4-methylsulfonyl-2-nitro-phenyl)sulfanyl-quinazolin-4-one

Systemtic Name: 3-(2-chlorophenyl)-2-(4-methylsulfonyl-2-nitro-phenyl)sulfanyl-quinazolin-4-one Openeye Name: 3-(2-chlorophenyl)-2-(4-methylsulfonyl-2-nitro-phenyl)sulfanyl-quinazolin-4-one CAS Name: 3-(2-chlorophenyl)-2-[(4-methylsulfonyl-2-nitrophenyl)thio]-4-quinazolinone IUPAC Name: 3-(2-chlorophenyl)-2-(4-methylsulfonyl-2-nitrophenyl)sulfanylquinazolin-4-one Traditional Name: 3-(2-chlorophenyl)-2-[(4-mesyl-2-nitro-phenyl)thio]quinazolin-4-one Formula: C21H14ClN3O5S2 MolecularWeight: 487.93596

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)SC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4Cl)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)SC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H14ClN3O5S2/c1-32(29,30)13-10-11-19(18(12-13)25(27)28)31-21-23-16-8-4-2-6-14(16)20(26)24(21)17-9-5-3-7-15(17)22/h2-12H,1H3