1-butyl-N,N-dimethyl-2-[1-(4-oxidanylidene-1H-quinazolin-2-yl)ethylsulfanyl]benzimidazole-5-sulfonamide

Systemtic Name: 1-butyl-N,N-dimethyl-2-[1-(4-oxidanylidene-1H-quinazolin-2-yl)ethylsulfanyl]benzimidazole-5-sulfonamide Openeye Name: 1-butyl-N,N-dimethyl-2-[1-(4-oxo-1H-quinazolin-2-yl)ethylsulfanyl]benzimidazole-5-sulfonamide CAS Name: 1-butyl-N,N-dimethyl-2-[1-(4-oxo-1H-quinazolin-2-yl)ethylthio]-5-benzimidazolesulfonamide IUPAC Name: 1-butyl-N,N-dimethyl-2-[1-(4-oxo-1H-quinazolin-2-yl)ethylsulfanyl]benzimidazole-5-sulfonamide Traditional Name: 1-butyl-2-[1-(4-keto-1H-quinazolin-2-yl)ethylthio]-N,N-dimethyl-benzimidazole-5-sulfonamide Formula: C23H27N5O3S2 MolecularWeight: 485.62218

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1SC(C)C3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1SC(C)C3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C23H27N5O3S2/c1-5-6-13-28-20-12-11-16(33(30,31)27(3)4)14-19(20)25-23(28)32-15(2)21-24-18-10-8-7-9-17(18)22(29)26-21/h7-12,14-15H,5-6,13H2,1-4H3,(H,24,26,29)