N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-butyl-2-(2-methylsulfonylbenzimidazol-1-yl)ethanamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-butyl-2-(2-methylsulfonylbenzimidazol-1-yl)ethanamide Openeye Name: N-butyl-N-(1,1-dioxothiolan-3-yl)-2-(2-methylsulfonylbenzimidazol-1-yl)acetamide CAS Name: N-butyl-N-(1,1-dioxo-3-thiolanyl)-2-(2-methylsulfonyl-1-benzimidazolyl)acetamide IUPAC Name: N-butyl-N-(1,1-dioxothiolan-3-yl)-2-(2-methylsulfonylbenzimidazol-1-yl)acetamide Traditional Name: N-butyl-N-(1,1-diketothiolan-3-yl)-2-(2-mesylbenzimidazol-1-yl)acetamide Formula: C18H25N3O5S2 MolecularWeight: 427.5382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1CCS(=O)(=O)C1)C(=O)CN2C3=CC=CC=C3N=C2S(=O)(=O)C

Isomeric SMILES

CCCCN(C1CCS(=O)(=O)C1)C(=O)CN2C3=CC=CC=C3N=C2S(=O)(=O)C

InChI

InChI=1S/C18H25N3O5S2/c1-3-4-10-20(14-9-11-28(25,26)13-14)17(22)12-21-16-8-6-5-7-15(16)19-18(21)27(2,23)24/h5-8,14H,3-4,9-13H2,1-2H3