ethyl 2-[(5-chloranyl-1-benzofuran-2-yl)carbonylamino]-5-methyl-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(5-chloranyl-1-benzofuran-2-yl)carbonylamino]-5-methyl-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[(5-chlorobenzofuran-2-carbonyl)amino]-5-methyl-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[(5-chloro-2-benzofuranyl)-oxomethyl]amino]-5-methyl-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(5-chloro-1-benzofuran-2-carbonyl)amino]-5-methyl-4-phenylthiophene-3-carboxylate Traditional Name: 2-[(5-chlorobenzofuran-2-carbonyl)amino]-5-methyl-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C23H18ClNO4S MolecularWeight: 439.91132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C)NC(=O)C3=CC4=C(O3)C=CC(=C4)Cl

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C)NC(=O)C3=CC4=C(O3)C=CC(=C4)Cl

InChI

InChI=1S/C23H18ClNO4S/c1-3-28-23(27)20-19(14-7-5-4-6-8-14)13(2)30-22(20)25-21(26)18-12-15-11-16(24)9-10-17(15)29-18/h4-12H,3H2,1-2H3,(H,25,26)