2-[2-[4-azanyl-1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidin-5-yl]-2-oxidanylidene-ethyl]sulfanyl-N-butyl-3H-benzimidazole-5-sulfonamide

Systemtic Name: 2-[2-[4-azanyl-1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidin-5-yl]-2-oxidanylidene-ethyl]sulfanyl-N-butyl-3H-benzimidazole-5-sulfonamide Openeye Name: 2-[2-(4-amino-1,3-dimethyl-2,6-dioxo-pyrimidin-5-yl)-2-oxo-ethyl]sulfanyl-N-butyl-3H-benzimidazole-5-sulfonamide CAS Name: 2-[[2-(4-amino-1,3-dimethyl-2,6-dioxo-5-pyrimidinyl)-2-oxoethyl]thio]-N-butyl-3H-benzimidazole-5-sulfonamide IUPAC Name: 2-[2-(4-amino-1,3-dimethyl-2,6-dioxopyrimidin-5-yl)-2-oxoethyl]sulfanyl-N-butyl-3H-benzimidazole-5-sulfonamide Traditional Name: 2-[[2-(4-amino-2,6-diketo-1,3-dimethyl-pyrimidin-5-yl)-2-keto-ethyl]thio]-N-butyl-3H-benzimidazole-5-sulfonamide Formula: C19H24N6O5S2 MolecularWeight: 480.56106

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNS(=O)(=O)C1=CC2=C(C=C1)N=C(N2)SCC(=O)C3=C(N(C(=O)N(C3=O)C)C)N

Isomeric SMILES

CCCCNS(=O)(=O)C1=CC2=C(C=C1)N=C(N2)SCC(=O)C3=C(N(C(=O)N(C3=O)C)C)N

InChI

InChI=1S/C19H24N6O5S2/c1-4-5-8-21-32(29,30)11-6-7-12-13(9-11)23-18(22-12)31-10-14(26)15-16(20)24(2)19(28)25(3)17(15)27/h6-7,9,21H,4-5,8,10,20H2,1-3H3,(H,22,23)