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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)C(C2=CC=CC=C2)[NH+](C)CC3=CC=C(S3)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)[C@H](C2=CC=CC=C2)[NH+](C)CC3=CC=C(S3)Cl

InChI

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