4-(4-chlorophenyl)-2-(pentanoylamino)thiophene-3-carboxylic acid

Systemtic Name: 4-(4-chlorophenyl)-2-(pentanoylamino)thiophene-3-carboxylic acid Openeye Name: 4-(4-chlorophenyl)-2-(pentanoylamino)thiophene-3-carboxylic acid CAS Name: 4-(4-chlorophenyl)-2-(1-oxopentylamino)-3-thiophenecarboxylic acid IUPAC Name: 4-(4-chlorophenyl)-2-(pentanoylamino)thiophene-3-carboxylic acid Traditional Name: 4-(4-chlorophenyl)-2-(valerylamino)-3-thenoic acid Formula: C16H16ClNO3S MolecularWeight: 337.82114

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=C(C(=CS1)C2=CC=C(C=C2)Cl)C(=O)O

Isomeric SMILES

CCCCC(=O)NC1=C(C(=CS1)C2=CC=C(C=C2)Cl)C(=O)O

InChI

InChI=1S/C16H16ClNO3S/c1-2-3-4-13(19)18-15-14(16(20)21)12(9-22-15)10-5-7-11(17)8-6-10/h5-9H,2-4H2,1H3,(H,18,19)(H,20,21)