methyl 2-(3-methyl-4-phenyl-5-phenylazanyl-1,2-thiazol-2-ium-2-yl)ethanoate

Systemtic Name: methyl 2-(3-methyl-4-phenyl-5-phenylazanyl-1,2-thiazol-2-ium-2-yl)ethanoate Openeye Name: methyl 2-(5-anilino-3-methyl-4-phenyl-isothiazol-2-ium-2-yl)acetate CAS Name: 2-(5-anilino-3-methyl-4-phenyl-2-isothiazol-2-iumyl)acetic acid methyl ester IUPAC Name: methyl 2-(5-anilino-3-methyl-4-phenyl-1,2-thiazol-2-ium-2-yl)acetate Traditional Name: 2-(5-anilino-3-methyl-4-phenyl-isothiazol-2-ium-2-yl)acetic acid methyl ester Formula: C19H19N2O2S+ MolecularWeight: 339.43136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](SC(=C1C2=CC=CC=C2)NC3=CC=CC=C3)CC(=O)OC

Isomeric SMILES

CC1=[N+](SC(=C1C2=CC=CC=C2)NC3=CC=CC=C3)CC(=O)OC

InChI

InChI=1S/C19H18N2O2S/c1-14-18(15-9-5-3-6-10-15)19(20-16-11-7-4-8-12-16)24-21(14)13-17(22)23-2/h3-12H,13H2,1-2H3/p+1