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

Systemtic Name: 3-(phenethylcarbamoylamino)-4-phenyl-thiophene-2-carboxylic acid Openeye Name: 3-(phenethylcarbamoylamino)-4-phenyl-thiophene-2-carboxylic acid CAS Name: 3-[[oxo-(phenethylamino)methyl]amino]-4-phenyl-2-thiophenecarboxylic acid IUPAC Name: 3-(phenethylcarbamoylamino)-4-phenylthiophene-2-carboxylic acid Traditional Name: 3-(phenethylcarbamoylamino)-4-phenyl-2-thenoic acid Formula: C20H18N2O3S MolecularWeight: 366.43352

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)NC2=C(SC=C2C3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)NC2=C(SC=C2C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C20H18N2O3S/c23-19(24)18-17(16(13-26-18)15-9-5-2-6-10-15)22-20(25)21-12-11-14-7-3-1-4-8-14/h1-10,13H,11-12H2,(H,23,24)(H2,21,22,25)