N-[(5-methylthiophen-2-yl)methyl]-1-oxidanidyl-pyridin-1-ium-3-carboxamide

Systemtic Name: N-[(5-methylthiophen-2-yl)methyl]-1-oxidanidyl-pyridin-1-ium-3-carboxamide Openeye Name: N-[(5-methyl-2-thienyl)methyl]-1-oxido-pyridin-1-ium-3-carboxamide CAS Name: N-[(5-methyl-2-thiophenyl)methyl]-1-oxido-3-pyridin-1-iumcarboxamide IUPAC Name: N-[(5-methylthiophen-2-yl)methyl]-1-oxidopyridin-1-ium-3-carboxamide Traditional Name: N-[(5-methyl-2-thienyl)methyl]-1-oxido-pyridin-1-ium-3-carboxamide Formula: C12H12N2O2S MolecularWeight: 248.30088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)CNC(=O)C2=C[N+](=CC=C2)[O-]

Isomeric SMILES

CC1=CC=C(S1)CNC(=O)C2=C[N+](=CC=C2)[O-]

InChI

InChI=1S/C12H12N2O2S/c1-9-4-5-11(17-9)7-13-12(15)10-3-2-6-14(16)8-10/h2-6,8H,7H2,1H3,(H,13,15)