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

Systemtic Name: 5-phenyl-3-(3-phenylpropylcarbamoylamino)thiophene-2-carboxylic acid Openeye Name: 5-phenyl-3-(3-phenylpropylcarbamoylamino)thiophene-2-carboxylic acid CAS Name: 3-[[oxo-(3-phenylpropylamino)methyl]amino]-5-phenyl-2-thiophenecarboxylic acid IUPAC Name: 5-phenyl-3-(3-phenylpropylcarbamoylamino)thiophene-2-carboxylic acid Traditional Name: 5-phenyl-3-(3-phenylpropylcarbamoylamino)-2-thenoic acid Formula: C21H20N2O3S MolecularWeight: 380.4601

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCNC(=O)NC2=C(SC(=C2)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCCNC(=O)NC2=C(SC(=C2)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C21H20N2O3S/c24-20(25)19-17(14-18(27-19)16-11-5-2-6-12-16)23-21(26)22-13-7-10-15-8-3-1-4-9-15/h1-6,8-9,11-12,14H,7,10,13H2,(H,24,25)(H2,22,23,26)