ethyl 4-(4-ethoxyphenyl)-2-[(2-phenethylphenyl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(4-ethoxyphenyl)-2-[(2-phenethylphenyl)carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(4-ethoxyphenyl)-2-[(2-phenethylbenzoyl)amino]thiophene-3-carboxylate CAS Name: 4-(4-ethoxyphenyl)-2-[[oxo-(2-phenethylphenyl)methyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-ethoxyphenyl)-2-[(2-phenethylbenzoyl)amino]thiophene-3-carboxylate Traditional Name: 2-[(2-phenethylbenzoyl)amino]-4-p-phenetyl-thiophene-3-carboxylic acid ethyl ester Formula: C30H29NO4S MolecularWeight: 499.62056

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=CSC(=C2C(=O)OCC)NC(=O)C3=CC=CC=C3CCC4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=CSC(=C2C(=O)OCC)NC(=O)C3=CC=CC=C3CCC4=CC=CC=C4

InChI

InChI=1S/C30H29NO4S/c1-3-34-24-18-16-23(17-19-24)26-20-36-29(27(26)30(33)35-4-2)31-28(32)25-13-9-8-12-22(25)15-14-21-10-6-5-7-11-21/h5-13,16-20H,3-4,14-15H2,1-2H3,(H,31,32)