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

Systemtic Name: N-(2-bromanyl-4,6-dinitro-phenyl)-3-(3-chloranyl-4-fluoranyl-phenyl)-4-(dicyanomethylidene)-2-methyl-quinazoline-6-sulfonamide Openeye Name: N-(2-bromo-4,6-dinitro-phenyl)-3-(3-chloro-4-fluoro-phenyl)-4-(dicyanomethylene)-2-methyl-quinazoline-6-sulfonamide CAS Name: N-(2-bromo-4,6-dinitrophenyl)-3-(3-chloro-4-fluorophenyl)-4-(dicyanomethylidene)-2-methyl-6-quinazolinesulfonamide IUPAC Name: N-(2-bromo-4,6-dinitrophenyl)-3-(3-chloro-4-fluorophenyl)-4-(dicyanomethylidene)-2-methylquinazoline-6-sulfonamide Traditional Name: N-(2-bromo-4,6-dinitro-phenyl)-3-(3-chloro-4-fluoro-phenyl)-4-(dicyanomethylene)-2-methyl-quinazoline-6-sulfonamide Formula: C24H12BrClFN7O6S MolecularWeight: 660.815783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)S(=O)(=O)NC3=C(C=C(C=C3Br)[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=C3Br)[N+](=O)[O-])[N+](=O)[O-])C(=C(C#N)C#N)N1C4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C24H12BrClFN7O6S/c1-12-30-21-5-3-16(41(39,40)31-23-18(25)6-15(33(35)36)8-22(23)34(37)38)9-17(21)24(13(10-28)11-29)32(12)14-2-4-20(27)19(26)7-14/h2-9,31H,1H3