N-(4-methyl-2-nitro-phenyl)-2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-2-phenyl-ethanamide

Systemtic Name: N-(4-methyl-2-nitro-phenyl)-2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-2-phenyl-ethanamide Openeye Name: 2-(3-allyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(4-methyl-2-nitro-phenyl)-2-phenyl-acetamide CAS Name: N-(4-methyl-2-nitrophenyl)-2-[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]-2-phenylacetamide IUPAC Name: N-(4-methyl-2-nitrophenyl)-2-(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanyl-2-phenylacetamide Traditional Name: 2-[(3-allyl-4-keto-quinazolin-2-yl)thio]-N-(4-methyl-2-nitro-phenyl)-2-phenyl-acetamide Formula: C26H22N4O4S MolecularWeight: 486.54228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C(C2=CC=CC=C2)SC3=NC4=CC=CC=C4C(=O)N3CC=C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C(C2=CC=CC=C2)SC3=NC4=CC=CC=C4C(=O)N3CC=C)[N+](=O)[O-]

InChI

InChI=1S/C26H22N4O4S/c1-3-15-29-25(32)19-11-7-8-12-20(19)28-26(29)35-23(18-9-5-4-6-10-18)24(31)27-21-14-13-17(2)16-22(21)30(33)34/h3-14,16,23H,1,15H2,2H3,(H,27,31)