1-butyl-N,N-diethyl-2-[(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methylsulfanyl]benzimidazole-5-sulfonamide

Systemtic Name: 1-butyl-N,N-diethyl-2-[(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methylsulfanyl]benzimidazole-5-sulfonamide Openeye Name: 1-butyl-N,N-diethyl-2-[(4-oxo-1,2,3-benzotriazin-3-yl)methylsulfanyl]benzimidazole-5-sulfonamide CAS Name: 1-butyl-N,N-diethyl-2-[(4-oxo-1,2,3-benzotriazin-3-yl)methylthio]-5-benzimidazolesulfonamide IUPAC Name: 1-butyl-N,N-diethyl-2-[(4-oxo-1,2,3-benzotriazin-3-yl)methylsulfanyl]benzimidazole-5-sulfonamide Traditional Name: 1-butyl-N,N-diethyl-2-[(4-keto-1,2,3-benzotriazin-3-yl)methylthio]benzimidazole-5-sulfonamide Formula: C23H28N6O3S2 MolecularWeight: 500.63682

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)N=C1SCN3C(=O)C4=CC=CC=C4N=N3

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)N=C1SCN3C(=O)C4=CC=CC=C4N=N3

InChI

InChI=1S/C23H28N6O3S2/c1-4-7-14-28-21-13-12-17(34(31,32)27(5-2)6-3)15-20(21)24-23(28)33-16-29-22(30)18-10-8-9-11-19(18)25-26-29/h8-13,15H,4-7,14,16H2,1-3H3