dimethyl 5-azanyl-3-[[2-(phenylcarbamoyl)phenoxy]methyl]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-azanyl-3-[[2-(phenylcarbamoyl)phenoxy]methyl]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-amino-3-[[2-(phenylcarbamoyl)phenoxy]methyl]thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[[2-[anilino(oxo)methyl]phenoxy]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-amino-3-[[2-(phenylcarbamoyl)phenoxy]methyl]thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[[2-(phenylcarbamoyl)phenoxy]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C22H20N2O6S MolecularWeight: 440.469

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=C1COC2=CC=CC=C2C(=O)NC3=CC=CC=C3)C(=O)OC)N

Isomeric SMILES

COC(=O)C1=C(SC(=C1COC2=CC=CC=C2C(=O)NC3=CC=CC=C3)C(=O)OC)N

InChI

InChI=1S/C22H20N2O6S/c1-28-21(26)17-15(18(22(27)29-2)31-19(17)23)12-30-16-11-7-6-10-14(16)20(25)24-13-8-4-3-5-9-13/h3-11H,12,23H2,1-2H3,(H,24,25)