2-(1H-benzimidazol-3-ium-2-ylsulfanyl)-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)ethanamide

Systemtic Name: 2-(1H-benzimidazol-3-ium-2-ylsulfanyl)-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)ethanamide Openeye Name: 2-(1H-benzimidazol-3-ium-2-ylsulfanyl)-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)acetamide CAS Name: 2-(1H-benzimidazol-3-ium-2-ylthio)-N-[2-(methylthio)-1,3-benzothiazol-6-yl]acetamide IUPAC Name: 2-(1H-benzimidazol-3-ium-2-ylsulfanyl)-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)acetamide Traditional Name: 2-(1H-benzimidazol-3-ium-2-ylthio)-N-[2-(methylthio)-1,3-benzothiazol-6-yl]acetamide Formula: C17H15N4OS3+ MolecularWeight: 387.5222

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)CSC3=[NH+]C4=CC=CC=C4N3

Isomeric SMILES

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)CSC3=[NH+]C4=CC=CC=C4N3

InChI

InChI=1S/C17H14N4OS3/c1-23-17-21-13-7-6-10(8-14(13)25-17)18-15(22)9-24-16-19-11-4-2-3-5-12(11)20-16/h2-8H,9H2,1H3,(H,18,22)(H,19,20)/p+1