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

Systemtic Name: methyl 4-(4-fluorophenyl)-2-[(3-propoxyphenyl)carbonylamino]thiophene-3-carboxylate Openeye Name: methyl 4-(4-fluorophenyl)-2-[(3-propoxybenzoyl)amino]thiophene-3-carboxylate CAS Name: 4-(4-fluorophenyl)-2-[[oxo-(3-propoxyphenyl)methyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-fluorophenyl)-2-[(3-propoxybenzoyl)amino]thiophene-3-carboxylate Traditional Name: 4-(4-fluorophenyl)-2-[(3-propoxybenzoyl)amino]thiophene-3-carboxylic acid methyl ester Formula: C22H20FNO4S MolecularWeight: 413.461903

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H20FNO4S/c1-3-11-28-17-6-4-5-15(12-17)20(25)24-21-19(22(26)27-2)18(13-29-21)14-7-9-16(23)10-8-14/h4-10,12-13H,3,11H2,1-2H3,(H,24,25)