N-(1,3-benzothiazol-2-yl)-2-[(3-methyl-1H-imidazol-3-ium-2-yl)sulfanyl]ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-[(3-methyl-1H-imidazol-3-ium-2-yl)sulfanyl]ethanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-[(3-methyl-1H-imidazol-3-ium-2-yl)sulfanyl]acetamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-[(3-methyl-1H-imidazol-3-ium-2-yl)thio]acetamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-[(3-methyl-1H-imidazol-3-ium-2-yl)sulfanyl]acetamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-[(3-methyl-1H-imidazol-3-ium-2-yl)thio]acetamide Formula: C13H13N4OS2+ MolecularWeight: 305.39852

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(NC=C1)SCC(=O)NC2=NC3=CC=CC=C3S2

Isomeric SMILES

C[N+]1=C(NC=C1)SCC(=O)NC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C13H12N4OS2/c1-17-7-6-14-13(17)19-8-11(18)16-12-15-9-4-2-3-5-10(9)20-12/h2-7H,8H2,1H3,(H,15,16,18)/p+1