2-[[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]methyl]-N,N-dimethyl-1-propyl-benzimidazole-5-sulfonamide

Systemtic Name: 2-[[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]methyl]-N,N-dimethyl-1-propyl-benzimidazole-5-sulfonamide Openeye Name: 2-[(1,3-dimethyl-2,6-dioxo-purin-7-yl)methyl]-N,N-dimethyl-1-propyl-benzimidazole-5-sulfonamide CAS Name: 2-[(1,3-dimethyl-2,6-dioxo-7-purinyl)methyl]-N,N-dimethyl-1-propyl-5-benzimidazolesulfonamide IUPAC Name: 2-[(1,3-dimethyl-2,6-dioxopurin-7-yl)methyl]-N,N-dimethyl-1-propylbenzimidazole-5-sulfonamide Traditional Name: 2-[(2,6-diketo-1,3-dimethyl-purin-7-yl)methyl]-N,N-dimethyl-1-propyl-benzimidazole-5-sulfonamide Formula: C20H25N7O4S MolecularWeight: 459.522

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CN3C=NC4=C3C(=O)N(C(=O)N4C)C

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CN3C=NC4=C3C(=O)N(C(=O)N4C)C

InChI

InChI=1S/C20H25N7O4S/c1-6-9-27-15-8-7-13(32(30,31)23(2)3)10-14(15)22-16(27)11-26-12-21-18-17(26)19(28)25(5)20(29)24(18)4/h7-8,10,12H,6,9,11H2,1-5H3