ethyl 4-[1-(2,5-dimethylthiophen-3-yl)ethylamino]benzoate

Systemtic Name: ethyl 4-[1-(2,5-dimethylthiophen-3-yl)ethylamino]benzoate Openeye Name: ethyl 4-[1-(2,5-dimethyl-3-thienyl)ethylamino]benzoate CAS Name: 4-[1-(2,5-dimethyl-3-thiophenyl)ethylamino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[1-(2,5-dimethylthiophen-3-yl)ethylamino]benzoate Traditional Name: 4-[1-(2,5-dimethyl-3-thienyl)ethylamino]benzoic acid ethyl ester Formula: C17H21NO2S MolecularWeight: 303.41914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(C)C2=C(SC(=C2)C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(C)C2=C(SC(=C2)C)C

InChI

InChI=1S/C17H21NO2S/c1-5-20-17(19)14-6-8-15(9-7-14)18-12(3)16-10-11(2)21-13(16)4/h6-10,12,18H,5H2,1-4H3