N-butyl-2-[(5-oxidanylidene-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methylsulfanyl]-3H-benzimidazole-5-sulfonamide

Systemtic Name: N-butyl-2-[(5-oxidanylidene-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methylsulfanyl]-3H-benzimidazole-5-sulfonamide Openeye Name: N-butyl-2-[(5-oxothiazolo[3,2-a]pyrimidin-7-yl)methylsulfanyl]-3H-benzimidazole-5-sulfonamide CAS Name: N-butyl-2-[(5-oxo-7-thiazolo[3,2-a]pyrimidinyl)methylthio]-3H-benzimidazole-5-sulfonamide IUPAC Name: N-butyl-2-[(5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methylsulfanyl]-3H-benzimidazole-5-sulfonamide Traditional Name: N-butyl-2-[(5-ketothiazolo[3,2-a]pyrimidin-7-yl)methylthio]-3H-benzimidazole-5-sulfonamide Formula: C18H19N5O3S3 MolecularWeight: 449.57016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNS(=O)(=O)C1=CC2=C(C=C1)N=C(N2)SCC3=CC(=O)N4C=CSC4=N3

Isomeric SMILES

CCCCNS(=O)(=O)C1=CC2=C(C=C1)N=C(N2)SCC3=CC(=O)N4C=CSC4=N3

InChI

InChI=1S/C18H19N5O3S3/c1-2-3-6-19-29(25,26)13-4-5-14-15(10-13)22-17(21-14)28-11-12-9-16(24)23-7-8-27-18(23)20-12/h4-5,7-10,19H,2-3,6,11H2,1H3,(H,21,22)