2-[[8-chloranyl-1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]methyl]-N,N-dimethyl-1-propyl-benzimidazole-5-sulfonamide

Systemtic Name: 2-[[8-chloranyl-1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]methyl]-N,N-dimethyl-1-propyl-benzimidazole-5-sulfonamide Openeye Name: 2-[(8-chloro-1,3-dimethyl-2,6-dioxo-purin-7-yl)methyl]-N,N-dimethyl-1-propyl-benzimidazole-5-sulfonamide CAS Name: 2-[(8-chloro-1,3-dimethyl-2,6-dioxo-7-purinyl)methyl]-N,N-dimethyl-1-propyl-5-benzimidazolesulfonamide IUPAC Name: 2-[(8-chloro-1,3-dimethyl-2,6-dioxopurin-7-yl)methyl]-N,N-dimethyl-1-propylbenzimidazole-5-sulfonamide Traditional Name: 2-[(8-chloro-2,6-diketo-1,3-dimethyl-purin-7-yl)methyl]-N,N-dimethyl-1-propyl-benzimidazole-5-sulfonamide Formula: C20H24ClN7O4S MolecularWeight: 493.96706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CN3C4=C(N=C3Cl)N(C(=O)N(C4=O)C)C

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CN3C4=C(N=C3Cl)N(C(=O)N(C4=O)C)C

InChI

InChI=1S/C20H24ClN7O4S/c1-6-9-27-14-8-7-12(33(31,32)24(2)3)10-13(14)22-15(27)11-28-16-17(23-19(28)21)25(4)20(30)26(5)18(16)29/h7-8,10H,6,9,11H2,1-5H3