(2S)-N-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-propanamide

Systemtic Name: (2S)-N-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-propanamide Openeye Name: (2S)-N-[4-(4-ethylphenyl)thiazol-2-yl]-2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-propanamide CAS Name: (2S)-N-[4-(4-ethylphenyl)-2-thiazolyl]-2-[(1-oxido-2-pyridin-1-iumyl)thio]propanamide IUPAC Name: (2S)-N-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]-2-(1-oxidopyridin-1-ium-2-yl)sulfanylpropanamide Traditional Name: (2S)-N-[4-(4-ethylphenyl)thiazol-2-yl]-2-[(1-oxidopyridin-1-ium-2-yl)thio]propionamide Formula: C19H19N3O2S2 MolecularWeight: 385.50306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C(C)SC3=CC=CC=[N+]3[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)[C@H](C)SC3=CC=CC=[N+]3[O-]

InChI

InChI=1S/C19H19N3O2S2/c1-3-14-7-9-15(10-8-14)16-12-25-19(20-16)21-18(23)13(2)26-17-6-4-5-11-22(17)24/h4-13H,3H2,1-2H3,(H,20,21,23)/t13-/m0/s1