2-(1H-benzimidazol-3-ium-2-ylsulfanyl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)ethanamide

Systemtic Name: 2-(1H-benzimidazol-3-ium-2-ylsulfanyl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)ethanamide Openeye Name: 2-(1H-benzimidazol-3-ium-2-ylsulfanyl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)acetamide CAS Name: 2-(1H-benzimidazol-3-ium-2-ylthio)-N-(5-propyl-1,3,4-thiadiazol-2-yl)acetamide IUPAC Name: 2-(1H-benzimidazol-3-ium-2-ylsulfanyl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)acetamide Traditional Name: 2-(1H-benzimidazol-3-ium-2-ylthio)-N-(5-propyl-1,3,4-thiadiazol-2-yl)acetamide Formula: C14H16N5OS2+ MolecularWeight: 334.43974

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(S1)NC(=O)CSC2=[NH+]C3=CC=CC=C3N2

Isomeric SMILES

CCCC1=NN=C(S1)NC(=O)CSC2=[NH+]C3=CC=CC=C3N2

InChI

InChI=1S/C14H15N5OS2/c1-2-5-12-18-19-14(22-12)17-11(20)8-21-13-15-9-6-3-4-7-10(9)16-13/h3-4,6-7H,2,5,8H2,1H3,(H,15,16)(H,17,19,20)/p+1