N-[5-[(4-chlorophenyl)methyl]-1,3-thiazol-2-yl]-1-oxidanidyl-pyridin-1-ium-3-carboxamide

Systemtic Name: N-[5-[(4-chlorophenyl)methyl]-1,3-thiazol-2-yl]-1-oxidanidyl-pyridin-1-ium-3-carboxamide Openeye Name: N-[5-[(4-chlorophenyl)methyl]thiazol-2-yl]-1-oxido-pyridin-1-ium-3-carboxamide CAS Name: N-[5-[(4-chlorophenyl)methyl]-2-thiazolyl]-1-oxido-3-pyridin-1-iumcarboxamide IUPAC Name: N-[5-[(4-chlorophenyl)methyl]-1,3-thiazol-2-yl]-1-oxidopyridin-1-ium-3-carboxamide Traditional Name: N-[5-(4-chlorobenzyl)thiazol-2-yl]-1-oxido-pyridin-1-ium-3-carboxamide Formula: C16H12ClN3O2S MolecularWeight: 345.80338

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C[N+](=C1)[O-])C(=O)NC2=NC=C(S2)CC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC(=C[N+](=C1)[O-])C(=O)NC2=NC=C(S2)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H12ClN3O2S/c17-13-5-3-11(4-6-13)8-14-9-18-16(23-14)19-15(21)12-2-1-7-20(22)10-12/h1-7,9-10H,8H2,(H,18,19,21)