methyl-[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]-[(5-phenyl-1,3-oxazol-2-yl)methyl]azanium

Systemtic Name: methyl-[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]-[(5-phenyl-1,3-oxazol-2-yl)methyl]azanium Openeye Name: methyl-[2-(2-methylsulfanylanilino)-2-oxo-ethyl]-[(5-phenyloxazol-2-yl)methyl]ammonium CAS Name: methyl-[2-[2-(methylthio)anilino]-2-oxoethyl]-[(5-phenyl-2-oxazolyl)methyl]ammonium IUPAC Name: methyl-[2-(2-methylsulfanylanilino)-2-oxoethyl]-[(5-phenyl-1,3-oxazol-2-yl)methyl]azanium Traditional Name: [2-keto-2-[2-(methylthio)anilino]ethyl]-methyl-[(5-phenyloxazol-2-yl)methyl]ammonium Formula: C20H22N3O2S+ MolecularWeight: 368.47258

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=NC=C(O1)C2=CC=CC=C2)CC(=O)NC3=CC=CC=C3SC

Isomeric SMILES

C[NH+](CC1=NC=C(O1)C2=CC=CC=C2)CC(=O)NC3=CC=CC=C3SC

InChI

InChI=1S/C20H21N3O2S/c1-23(13-19(24)22-16-10-6-7-11-18(16)26-2)14-20-21-12-17(25-20)15-8-4-3-5-9-15/h3-12H,13-14H2,1-2H3,(H,22,24)/p+1