O4-ethyl O2-propan-2-yl 3-methyl-5-[(2-phenethylphenyl)carbonylamino]thiophene-2,4-dicarboxylate

Systemtic Name: O4-ethyl O2-propan-2-yl 3-methyl-5-[(2-phenethylphenyl)carbonylamino]thiophene-2,4-dicarboxylate Openeye Name: O4-ethyl O2-isopropyl 3-methyl-5-[(2-phenethylbenzoyl)amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[oxo-(2-phenethylphenyl)methyl]amino]thiophene-2,4-dicarboxylic acid O4-ethyl ester O2-propan-2-yl ester IUPAC Name: 4-O-ethyl 2-O-propan-2-yl 3-methyl-5-[(2-phenethylbenzoyl)amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[(2-phenethylbenzoyl)amino]thiophene-2,4-dicarboxylic acid O4-ethyl ester O2-isopropyl ester Formula: C27H29NO5S MolecularWeight: 479.58786

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OC(C)C)NC(=O)C2=CC=CC=C2CCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OC(C)C)NC(=O)C2=CC=CC=C2CCC3=CC=CC=C3

InChI

InChI=1S/C27H29NO5S/c1-5-32-26(30)22-18(4)23(27(31)33-17(2)3)34-25(22)28-24(29)21-14-10-9-13-20(21)16-15-19-11-7-6-8-12-19/h6-14,17H,5,15-16H2,1-4H3,(H,28,29)