3-(3,4-dimethoxyphenyl)-2-(4-nitrophenyl)sulfanyl-quinazolin-4-one

Systemtic Name: 3-(3,4-dimethoxyphenyl)-2-(4-nitrophenyl)sulfanyl-quinazolin-4-one Openeye Name: 3-(3,4-dimethoxyphenyl)-2-(4-nitrophenyl)sulfanyl-quinazolin-4-one CAS Name: 3-(3,4-dimethoxyphenyl)-2-[(4-nitrophenyl)thio]-4-quinazolinone IUPAC Name: 3-(3,4-dimethoxyphenyl)-2-(4-nitrophenyl)sulfanylquinazolin-4-one Traditional Name: 3-(3,4-dimethoxyphenyl)-2-[(4-nitrophenyl)thio]quinazolin-4-one Formula: C22H17N3O5S MolecularWeight: 435.45248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SC4=CC=C(C=C4)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SC4=CC=C(C=C4)[N+](=O)[O-])OC

InChI

InChI=1S/C22H17N3O5S/c1-29-19-12-9-15(13-20(19)30-2)24-21(26)17-5-3-4-6-18(17)23-22(24)31-16-10-7-14(8-11-16)25(27)28/h3-13H,1-2H3