methyl 2-[2-[3-(methylamino)-5-phenyl-thiophen-2-yl]ethyl]benzoate

Systemtic Name: methyl 2-[2-[3-(methylamino)-5-phenyl-thiophen-2-yl]ethyl]benzoate Openeye Name: methyl 2-[2-[3-(methylamino)-5-phenyl-2-thienyl]ethyl]benzoate CAS Name: 2-[2-[3-(methylamino)-5-phenyl-2-thiophenyl]ethyl]benzoic acid methyl ester IUPAC Name: methyl 2-[2-[3-(methylamino)-5-phenylthiophen-2-yl]ethyl]benzoate Traditional Name: 2-[2-[3-(methylamino)-5-phenyl-2-thienyl]ethyl]benzoic acid methyl ester Formula: C21H21NO2S MolecularWeight: 351.46194

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(SC(=C1)C2=CC=CC=C2)CCC3=CC=CC=C3C(=O)OC

Isomeric SMILES

CNC1=C(SC(=C1)C2=CC=CC=C2)CCC3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C21H21NO2S/c1-22-18-14-20(16-9-4-3-5-10-16)25-19(18)13-12-15-8-6-7-11-17(15)21(23)24-2/h3-11,14,22H,12-13H2,1-2H3