methyl 3-[1-(2,5-dimethylthiophen-3-yl)ethylamino]benzoate

Systemtic Name: methyl 3-[1-(2,5-dimethylthiophen-3-yl)ethylamino]benzoate Openeye Name: methyl 3-[1-(2,5-dimethyl-3-thienyl)ethylamino]benzoate CAS Name: 3-[1-(2,5-dimethyl-3-thiophenyl)ethylamino]benzoic acid methyl ester IUPAC Name: methyl 3-[1-(2,5-dimethylthiophen-3-yl)ethylamino]benzoate Traditional Name: 3-[1-(2,5-dimethyl-3-thienyl)ethylamino]benzoic acid methyl ester Formula: C16H19NO2S MolecularWeight: 289.39256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(C)NC2=CC=CC(=C2)C(=O)OC

Isomeric SMILES

CC1=CC(=C(S1)C)C(C)NC2=CC=CC(=C2)C(=O)OC

InChI

InChI=1S/C16H19NO2S/c1-10-8-15(12(3)20-10)11(2)17-14-7-5-6-13(9-14)16(18)19-4/h5-9,11,17H,1-4H3