N-[3-[(4-methylphenyl)methyl]-1,3-thiazol-2-ylidene]-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[3-[(4-methylphenyl)methyl]-1,3-thiazol-2-ylidene]-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethanamide Openeye Name: 2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-N-[3-(p-tolylmethyl)thiazol-2-ylidene]acetamide CAS Name: N-[3-[(4-methylphenyl)methyl]-2-thiazolylidene]-2-[(1-oxido-2-pyridin-1-iumyl)thio]acetamide IUPAC Name: N-[3-[(4-methylphenyl)methyl]-1,3-thiazol-2-ylidene]-2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetamide Traditional Name: N-[3-(4-methylbenzyl)-4-thiazolin-2-ylidene]-2-[(1-oxidopyridin-1-ium-2-yl)thio]acetamide Formula: C18H17N3O2S2 MolecularWeight: 371.47648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C=CSC2=NC(=O)CSC3=CC=CC=[N+]3[O-]

Isomeric SMILES

CC1=CC=C(C=C1)CN2C=CSC2=NC(=O)CSC3=CC=CC=[N+]3[O-]

InChI

InChI=1S/C18H17N3O2S2/c1-14-5-7-15(8-6-14)12-20-10-11-24-18(20)19-16(22)13-25-17-4-2-3-9-21(17)23/h2-11H,12-13H2,1H3