5-[(1-ethyl-2-methyl-benzimidazol-5-yl)methyl]-1,1-bis(oxidanylidene)-1,2,5-thiadiazolidin-3-one

Systemtic Name: 5-[(1-ethyl-2-methyl-benzimidazol-5-yl)methyl]-1,1-bis(oxidanylidene)-1,2,5-thiadiazolidin-3-one Openeye Name: 5-[(1-ethyl-2-methyl-benzimidazol-5-yl)methyl]-1,1-dioxo-1,2,5-thiadiazolidin-3-one CAS Name: 5-[(1-ethyl-2-methyl-5-benzimidazolyl)methyl]-1,1-dioxo-1,2,5-thiadiazolidin-3-one IUPAC Name: 5-[(1-ethyl-2-methylbenzimidazol-5-yl)methyl]-1,1-dioxo-1,2,5-thiadiazolidin-3-one Traditional Name: 5-[(1-ethyl-2-methyl-benzimidazol-5-yl)methyl]-1,1-diketo-1,2,5-thiadiazolidin-3-one Formula: C13H16N4O3S MolecularWeight: 308.35614

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NC2=C1C=CC(=C2)CN3CC(=O)NS3(=O)=O)C

Isomeric SMILES

CCN1C(=NC2=C1C=CC(=C2)CN3CC(=O)NS3(=O)=O)C

InChI

InChI=1S/C13H16N4O3S/c1-3-17-9(2)14-11-6-10(4-5-12(11)17)7-16-8-13(18)15-21(16,19)20/h4-6H,3,7-8H2,1-2H3,(H,15,18)