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

Systemtic Name: N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-1-oxidanidyl-pyridin-1-ium-2-carboxamide Openeye Name: N-[4-(3,4-dimethoxyphenyl)thiazol-2-yl]-1-oxido-pyridin-1-ium-2-carboxamide CAS Name: N-[4-(3,4-dimethoxyphenyl)-2-thiazolyl]-1-oxido-2-pyridin-1-iumcarboxamide IUPAC Name: N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-1-oxidopyridin-1-ium-2-carboxamide Traditional Name: N-[4-(3,4-dimethoxyphenyl)thiazol-2-yl]-1-oxido-pyridin-1-ium-2-carboxamide Formula: C17H15N3O4S MolecularWeight: 357.3837

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC=CC=[N+]3[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC=CC=[N+]3[O-])OC

InChI

InChI=1S/C17H15N3O4S/c1-23-14-7-6-11(9-15(14)24-2)12-10-25-17(18-12)19-16(21)13-5-3-4-8-20(13)22/h3-10H,1-2H3,(H,18,19,21)