1-butyl-2-[[methyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]amino]methyl]benzimidazole-5-sulfonamide

Systemtic Name: 1-butyl-2-[[methyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]amino]methyl]benzimidazole-5-sulfonamide Openeye Name: 1-butyl-2-[[methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]methyl]benzimidazole-5-sulfonamide CAS Name: 1-butyl-2-[[methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]methyl]-5-benzimidazolesulfonamide IUPAC Name: 1-butyl-2-[[methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]methyl]benzimidazole-5-sulfonamide Traditional Name: 1-butyl-2-[[(4-keto-1H-quinazolin-2-yl)methyl-methyl-amino]methyl]benzimidazole-5-sulfonamide Formula: C22H26N6O3S MolecularWeight: 454.54524

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CN(C)CC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CN(C)CC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C22H26N6O3S/c1-3-4-11-28-19-10-9-15(32(23,30)31)12-18(19)25-21(28)14-27(2)13-20-24-17-8-6-5-7-16(17)22(29)26-20/h5-10,12H,3-4,11,13-14H2,1-2H3,(H2,23,30,31)(H,24,26,29)