ethyl 2-(2-benzo[e][1]benzofuran-1-ylethanoylamino)-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-(2-benzo[e][1]benzofuran-1-ylethanoylamino)-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[(2-benzo[e]benzofuran-1-ylacetyl)amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[2-(1-benzo[e]benzofuranyl)-1-oxoethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2-benzo[e][1]benzofuran-1-ylacetyl)amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[(2-benzo[e]benzofuran-1-ylacetyl)amino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C23H21NO4S MolecularWeight: 407.48214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CC2=COC3=C2C4=CC=CC=C4C=C3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CC2=COC3=C2C4=CC=CC=C4C=C3

InChI

InChI=1S/C23H21NO4S/c1-4-27-23(26)20-13(2)14(3)29-22(20)24-19(25)11-16-12-28-18-10-9-15-7-5-6-8-17(15)21(16)18/h5-10,12H,4,11H2,1-3H3,(H,24,25)