2-[[1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidin-4-yl]methylsulfanyl]-1-propyl-benzimidazole-5-sulfonamide

Systemtic Name: 2-[[1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidin-4-yl]methylsulfanyl]-1-propyl-benzimidazole-5-sulfonamide Openeye Name: 2-[(1,3-dimethyl-2,6-dioxo-pyrimidin-4-yl)methylsulfanyl]-1-propyl-benzimidazole-5-sulfonamide CAS Name: 2-[(1,3-dimethyl-2,6-dioxo-4-pyrimidinyl)methylthio]-1-propyl-5-benzimidazolesulfonamide IUPAC Name: 2-[(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)methylsulfanyl]-1-propylbenzimidazole-5-sulfonamide Traditional Name: 2-[(2,6-diketo-1,3-dimethyl-pyrimidin-4-yl)methylthio]-1-propyl-benzimidazole-5-sulfonamide Formula: C17H21N5O4S2 MolecularWeight: 423.50974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC3=CC(=O)N(C(=O)N3C)C

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC3=CC(=O)N(C(=O)N3C)C

InChI

InChI=1S/C17H21N5O4S2/c1-4-7-22-14-6-5-12(28(18,25)26)9-13(14)19-16(22)27-10-11-8-15(23)21(3)17(24)20(11)2/h5-6,8-9H,4,7,10H2,1-3H3,(H2,18,25,26)