[(1S)-2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]-methyl-(thiophen-3-ylmethyl)azanium

Systemtic Name: [(1S)-2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]-methyl-(thiophen-3-ylmethyl)azanium Openeye Name: [(1S)-2-(2,5-dimethylanilino)-2-oxo-1-phenyl-ethyl]-methyl-(3-thienylmethyl)ammonium CAS Name: [(1S)-2-(2,5-dimethylanilino)-2-oxo-1-phenylethyl]-methyl-(3-thiophenylmethyl)ammonium IUPAC Name: [(1S)-2-(2,5-dimethylanilino)-2-oxo-1-phenylethyl]-methyl-(thiophen-3-ylmethyl)azanium Traditional Name: [(1S)-2-(2,5-dimethylanilino)-2-keto-1-phenyl-ethyl]-methyl-(3-thenyl)ammonium Formula: C22H25N2OS+ MolecularWeight: 365.5117

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C(C2=CC=CC=C2)[NH+](C)CC3=CSC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)[C@H](C2=CC=CC=C2)[NH+](C)CC3=CSC=C3

InChI

InChI=1S/C22H24N2OS/c1-16-9-10-17(2)20(13-16)23-22(25)21(19-7-5-4-6-8-19)24(3)14-18-11-12-26-15-18/h4-13,15,21H,14H2,1-3H3,(H,23,25)/p+1/t21-/m0/s1