4-phenyl-3-(2-phenylpropylcarbamoylamino)thiophene-2-carboxylic acid

Systemtic Name: 4-phenyl-3-(2-phenylpropylcarbamoylamino)thiophene-2-carboxylic acid Openeye Name: 4-phenyl-3-(2-phenylpropylcarbamoylamino)thiophene-2-carboxylic acid CAS Name: 3-[[oxo-(2-phenylpropylamino)methyl]amino]-4-phenyl-2-thiophenecarboxylic acid IUPAC Name: 4-phenyl-3-(2-phenylpropylcarbamoylamino)thiophene-2-carboxylic acid Traditional Name: 4-phenyl-3-(2-phenylpropylcarbamoylamino)-2-thenoic acid Formula: C21H20N2O3S MolecularWeight: 380.4601

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)NC1=C(SC=C1C2=CC=CC=C2)C(=O)O)C3=CC=CC=C3

Isomeric SMILES

CC(CNC(=O)NC1=C(SC=C1C2=CC=CC=C2)C(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C21H20N2O3S/c1-14(15-8-4-2-5-9-15)12-22-21(26)23-18-17(13-27-19(18)20(24)25)16-10-6-3-7-11-16/h2-11,13-14H,12H2,1H3,(H,24,25)(H2,22,23,26)