3-(3-chloranyl-4-fluoranyl-phenyl)-4-(dicyanomethylidene)-N-(2,4-dinitrophenyl)-2-methyl-quinazoline-6-sulfonamide

Systemtic Name: 3-(3-chloranyl-4-fluoranyl-phenyl)-4-(dicyanomethylidene)-N-(2,4-dinitrophenyl)-2-methyl-quinazoline-6-sulfonamide Openeye Name: 3-(3-chloro-4-fluoro-phenyl)-4-(dicyanomethylene)-N-(2,4-dinitrophenyl)-2-methyl-quinazoline-6-sulfonamide CAS Name: 3-(3-chloro-4-fluorophenyl)-4-(dicyanomethylidene)-N-(2,4-dinitrophenyl)-2-methyl-6-quinazolinesulfonamide IUPAC Name: 3-(3-chloro-4-fluorophenyl)-4-(dicyanomethylidene)-N-(2,4-dinitrophenyl)-2-methylquinazoline-6-sulfonamide Traditional Name: 3-(3-chloro-4-fluoro-phenyl)-4-(dicyanomethylene)-N-(2,4-dinitrophenyl)-2-methyl-quinazoline-6-sulfonamide Formula: C24H13ClFN7O6S MolecularWeight: 581.919723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)S(=O)(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])C(=C(C#N)C#N)N1C4=CC(=C(C=C4)F)Cl

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)S(=O)(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])C(=C(C#N)C#N)N1C4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C24H13ClFN7O6S/c1-13-29-21-7-4-17(40(38,39)30-22-6-3-16(32(34)35)9-23(22)33(36)37)10-18(21)24(14(11-27)12-28)31(13)15-2-5-20(26)19(25)8-15/h2-10,30H,1H3