N-(2,3-dimethyl-6-nitro-phenyl)-2-[3-(3-methoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide

Systemtic Name: N-(2,3-dimethyl-6-nitro-phenyl)-2-[3-(3-methoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide Openeye Name: N-(2,3-dimethyl-6-nitro-phenyl)-2-[3-(3-methoxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-propanamide CAS Name: N-(2,3-dimethyl-6-nitrophenyl)-2-[[3-(3-methoxypropyl)-4-oxo-2-quinazolinyl]thio]propanamide IUPAC Name: N-(2,3-dimethyl-6-nitrophenyl)-2-[3-(3-methoxypropyl)-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: N-(2,3-dimethyl-6-nitro-phenyl)-2-[[4-keto-3-(3-methoxypropyl)quinazolin-2-yl]thio]propionamide Formula: C23H26N4O5S MolecularWeight: 470.54134

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)[N+](=O)[O-])NC(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2CCCOC)C

Isomeric SMILES

CC1=C(C(=C(C=C1)[N+](=O)[O-])NC(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2CCCOC)C

InChI

InChI=1S/C23H26N4O5S/c1-14-10-11-19(27(30)31)20(15(14)2)25-21(28)16(3)33-23-24-18-9-6-5-8-17(18)22(29)26(23)12-7-13-32-4/h5-6,8-11,16H,7,12-13H2,1-4H3,(H,25,28)