N-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]-1-oxidanidyl-pyridin-1-ium-3-carboxamide

Systemtic Name: N-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]-1-oxidanidyl-pyridin-1-ium-3-carboxamide Openeye Name: N-[4-(3,4-dimethylphenyl)thiazol-2-yl]-1-oxido-pyridin-1-ium-3-carboxamide CAS Name: N-[4-(3,4-dimethylphenyl)-2-thiazolyl]-1-oxido-3-pyridin-1-iumcarboxamide IUPAC Name: N-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]-1-oxidopyridin-1-ium-3-carboxamide Traditional Name: N-[4-(3,4-dimethylphenyl)thiazol-2-yl]-1-oxido-pyridin-1-ium-3-carboxamide Formula: C17H15N3O2S MolecularWeight: 325.3849

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)C3=C[N+](=CC=C3)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)C3=C[N+](=CC=C3)[O-])C

InChI

InChI=1S/C17H15N3O2S/c1-11-5-6-13(8-12(11)2)15-10-23-17(18-15)19-16(21)14-4-3-7-20(22)9-14/h3-10H,1-2H3,(H,18,19,21)