2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]-N-(5-methyl-1,2-oxazol-3-yl)ethanamide

Systemtic Name: 2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]-N-(5-methyl-1,2-oxazol-3-yl)ethanamide Openeye Name: 2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]-N-(5-methylisoxazol-3-yl)acetamide CAS Name: 2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)thio]-N-(5-methyl-3-isoxazolyl)acetamide IUPAC Name: 2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide Traditional Name: 2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)thio]-N-(5-methylisoxazol-3-yl)acetamide Formula: C14H15N4O2S+ MolecularWeight: 303.3595

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)CSC2=[N+](C3=CC=CC=C3N2)C

Isomeric SMILES

CC1=CC(=NO1)NC(=O)CSC2=[N+](C3=CC=CC=C3N2)C

InChI

InChI=1S/C14H14N4O2S/c1-9-7-12(17-20-9)16-13(19)8-21-14-15-10-5-3-4-6-11(10)18(14)2/h3-7H,8H2,1-2H3,(H,16,17,19)/p+1