1-ethyl-2-[(8-methyl-4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]benzimidazole-5-sulfonamide

Systemtic Name: 1-ethyl-2-[(8-methyl-4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]benzimidazole-5-sulfonamide Openeye Name: 1-ethyl-2-[(8-methyl-4-oxo-1H-quinazolin-2-yl)methylsulfanyl]benzimidazole-5-sulfonamide CAS Name: 1-ethyl-2-[(8-methyl-4-oxo-1H-quinazolin-2-yl)methylthio]-5-benzimidazolesulfonamide IUPAC Name: 1-ethyl-2-[(8-methyl-4-oxo-1H-quinazolin-2-yl)methylsulfanyl]benzimidazole-5-sulfonamide Traditional Name: 1-ethyl-2-[(4-keto-8-methyl-1H-quinazolin-2-yl)methylthio]benzimidazole-5-sulfonamide Formula: C19H19N5O3S2 MolecularWeight: 429.51586

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC3=NC(=O)C4=C(N3)C(=CC=C4)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC3=NC(=O)C4=C(N3)C(=CC=C4)C

InChI

InChI=1S/C19H19N5O3S2/c1-3-24-15-8-7-12(29(20,26)27)9-14(15)21-19(24)28-10-16-22-17-11(2)5-4-6-13(17)18(25)23-16/h4-9H,3,10H2,1-2H3,(H2,20,26,27)(H,22,23,25)