(5-chloranylthiophen-2-yl)methyl-[(1S)-2-[(2-ethoxyphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]-methyl-azanium

Systemtic Name: (5-chloranylthiophen-2-yl)methyl-[(1S)-2-[(2-ethoxyphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]-methyl-azanium Openeye Name: (5-chloro-2-thienyl)methyl-[(1S)-2-(2-ethoxyanilino)-2-oxo-1-phenyl-ethyl]-methyl-ammonium CAS Name: (5-chloro-2-thiophenyl)methyl-[(1S)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl]-methylammonium IUPAC Name: (5-chlorothiophen-2-yl)methyl-[(1S)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl]-methylazanium Traditional Name: (5-chloro-2-thienyl)methyl-[(1S)-2-keto-2-(o-phenetidino)-1-phenyl-ethyl]-methyl-ammonium Formula: C22H24ClN2O2S+ MolecularWeight: 415.95616

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)C(C2=CC=CC=C2)[NH+](C)CC3=CC=C(S3)Cl

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)[C@H](C2=CC=CC=C2)[NH+](C)CC3=CC=C(S3)Cl

InChI

InChI=1S/C22H23ClN2O2S/c1-3-27-19-12-8-7-11-18(19)24-22(26)21(16-9-5-4-6-10-16)25(2)15-17-13-14-20(23)28-17/h4-14,21H,3,15H2,1-2H3,(H,24,26)/p+1/t21-/m0/s1