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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)C3=CC4=C(O3)C=CC(=C4)Cl

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)C3=CC4=C(O3)C=CC(=C4)Cl

InChI

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