ethyl 5-(4-aminophenyl)-4-(4-methylsulfonylphenyl)thiophene-2-carboxylate

Systemtic Name: ethyl 5-(4-aminophenyl)-4-(4-methylsulfonylphenyl)thiophene-2-carboxylate Openeye Name: ethyl 5-(4-aminophenyl)-4-(4-methylsulfonylphenyl)thiophene-2-carboxylate CAS Name: 5-(4-aminophenyl)-4-(4-methylsulfonylphenyl)-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-aminophenyl)-4-(4-methylsulfonylphenyl)thiophene-2-carboxylate Traditional Name: 5-(4-aminophenyl)-4-(4-mesylphenyl)thiophene-2-carboxylic acid ethyl ester Formula: C20H19NO4S2 MolecularWeight: 401.49916

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(S1)C2=CC=C(C=C2)N)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1=CC(=C(S1)C2=CC=C(C=C2)N)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C20H19NO4S2/c1-3-25-20(22)18-12-17(13-6-10-16(11-7-13)27(2,23)24)19(26-18)14-4-8-15(21)9-5-14/h4-12H,3,21H2,1-2H3