N-[4-[2-[(3-methyl-1H-imidazol-3-ium-2-yl)sulfanyl]ethanoyl]phenyl]ethanamide

Systemtic Name: N-[4-[2-[(3-methyl-1H-imidazol-3-ium-2-yl)sulfanyl]ethanoyl]phenyl]ethanamide Openeye Name: N-[4-[2-[(3-methyl-1H-imidazol-3-ium-2-yl)sulfanyl]acetyl]phenyl]acetamide CAS Name: N-[4-[2-[(3-methyl-1H-imidazol-3-ium-2-yl)thio]-1-oxoethyl]phenyl]acetamide IUPAC Name: N-[4-[2-[(3-methyl-1H-imidazol-3-ium-2-yl)sulfanyl]acetyl]phenyl]acetamide Traditional Name: N-[4-[2-[(3-methyl-1H-imidazol-3-ium-2-yl)thio]acetyl]phenyl]acetamide Formula: C14H16N3O2S+ MolecularWeight: 290.36074

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C(=O)CSC2=[N+](C=CN2)C

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C(=O)CSC2=[N+](C=CN2)C

InChI

InChI=1S/C14H15N3O2S/c1-10(18)16-12-5-3-11(4-6-12)13(19)9-20-14-15-7-8-17(14)2/h3-8H,9H2,1-2H3,(H,16,18,19)/p+1