methyl 2-[3-(5-ethylfuran-2-yl)propanoylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[3-(5-ethylfuran-2-yl)propanoylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: methyl 2-[3-(5-ethyl-2-furyl)propanoylamino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[3-(5-ethyl-2-furanyl)-1-oxopropyl]amino]-4-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[3-(5-ethylfuran-2-yl)propanoylamino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[3-(5-ethyl-2-furyl)propanoylamino]-4-phenyl-thiophene-3-carboxylic acid methyl ester Formula: C21H21NO4S MolecularWeight: 383.46074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(O1)CCC(=O)NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CCC1=CC=C(O1)CCC(=O)NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C21H21NO4S/c1-3-15-9-10-16(26-15)11-12-18(23)22-20-19(21(24)25-2)17(13-27-20)14-7-5-4-6-8-14/h4-10,13H,3,11-12H2,1-2H3,(H,22,23)