(5-chloranylthiophen-2-yl)methyl-[(1R)-2-[(3-methoxyphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]-methyl-azanium

Systemtic Name: (5-chloranylthiophen-2-yl)methyl-[(1R)-2-[(3-methoxyphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]-methyl-azanium Openeye Name: (5-chloro-2-thienyl)methyl-[(1R)-2-(3-methoxyanilino)-2-oxo-1-phenyl-ethyl]-methyl-ammonium CAS Name: (5-chloro-2-thiophenyl)methyl-[(1R)-2-(3-methoxyanilino)-2-oxo-1-phenylethyl]-methylammonium IUPAC Name: (5-chlorothiophen-2-yl)methyl-[(1R)-2-(3-methoxyanilino)-2-oxo-1-phenylethyl]-methylazanium Traditional Name: (5-chloro-2-thienyl)methyl-[(1R)-2-keto-2-(m-anisidino)-1-phenyl-ethyl]-methyl-ammonium Formula: C21H22ClN2O2S+ MolecularWeight: 401.92958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(S1)Cl)C(C2=CC=CC=C2)C(=O)NC3=CC(=CC=C3)OC

Isomeric SMILES

C[NH+](CC1=CC=C(S1)Cl)[C@H](C2=CC=CC=C2)C(=O)NC3=CC(=CC=C3)OC

InChI

InChI=1S/C21H21ClN2O2S/c1-24(14-18-11-12-19(22)27-18)20(15-7-4-3-5-8-15)21(25)23-16-9-6-10-17(13-16)26-2/h3-13,20H,14H2,1-2H3,(H,23,25)/p+1/t20-/m1/s1