methyl 4-(2-chlorophenyl)-2-[(3-propoxyphenyl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4-(2-chlorophenyl)-2-[(3-propoxyphenyl)carbonylamino]thiophene-3-carboxylate Openeye Name: methyl 4-(2-chlorophenyl)-2-[(3-propoxybenzoyl)amino]thiophene-3-carboxylate CAS Name: 4-(2-chlorophenyl)-2-[[oxo-(3-propoxyphenyl)methyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(2-chlorophenyl)-2-[(3-propoxybenzoyl)amino]thiophene-3-carboxylate Traditional Name: 4-(2-chlorophenyl)-2-[(3-propoxybenzoyl)amino]thiophene-3-carboxylic acid methyl ester Formula: C22H20ClNO4S MolecularWeight: 429.9165

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C(=O)NC2=C(C(=CS2)C3=CC=CC=C3Cl)C(=O)OC

Isomeric SMILES

CCCOC1=CC=CC(=C1)C(=O)NC2=C(C(=CS2)C3=CC=CC=C3Cl)C(=O)OC

InChI

InChI=1S/C22H20ClNO4S/c1-3-11-28-15-8-6-7-14(12-15)20(25)24-21-19(22(26)27-2)17(13-29-21)16-9-4-5-10-18(16)23/h4-10,12-13H,3,11H2,1-2H3,(H,24,25)