2-[1-oxidanylidene-1-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)propan-2-yl]sulfanyl-1-propyl-benzimidazole-5-sulfonamide

Systemtic Name: 2-[1-oxidanylidene-1-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)propan-2-yl]sulfanyl-1-propyl-benzimidazole-5-sulfonamide Openeye Name: 2-[1-methyl-2-oxo-2-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl]sulfanyl-1-propyl-benzimidazole-5-sulfonamide CAS Name: 2-[[1-oxo-1-(3-oxo-4H-1,4-benzoxazin-6-yl)propan-2-yl]thio]-1-propyl-5-benzimidazolesulfonamide IUPAC Name: 2-[1-oxo-1-(3-oxo-4H-1,4-benzoxazin-6-yl)propan-2-yl]sulfanyl-1-propylbenzimidazole-5-sulfonamide Traditional Name: 2-[[2-keto-2-(3-keto-4H-1,4-benzoxazin-6-yl)-1-methyl-ethyl]thio]-1-propyl-benzimidazole-5-sulfonamide Formula: C21H22N4O5S2 MolecularWeight: 474.55318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SC(C)C(=O)C3=CC4=C(C=C3)OCC(=O)N4

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SC(C)C(=O)C3=CC4=C(C=C3)OCC(=O)N4

InChI

InChI=1S/C21H22N4O5S2/c1-3-8-25-17-6-5-14(32(22,28)29)10-15(17)24-21(25)31-12(2)20(27)13-4-7-18-16(9-13)23-19(26)11-30-18/h4-7,9-10,12H,3,8,11H2,1-2H3,(H,23,26)(H2,22,28,29)