5-methyl-2-(pentanoylamino)-4-phenyl-thiophene-3-carboxylic acid

Systemtic Name: 5-methyl-2-(pentanoylamino)-4-phenyl-thiophene-3-carboxylic acid Openeye Name: 5-methyl-2-(pentanoylamino)-4-phenyl-thiophene-3-carboxylic acid CAS Name: 5-methyl-2-(1-oxopentylamino)-4-phenyl-3-thiophenecarboxylic acid IUPAC Name: 5-methyl-2-(pentanoylamino)-4-phenylthiophene-3-carboxylic acid Traditional Name: 5-methyl-4-phenyl-2-(valerylamino)-3-thenoic acid Formula: C17H19NO3S MolecularWeight: 317.40266

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=C(C(=C(S1)C)C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CCCCC(=O)NC1=C(C(=C(S1)C)C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C17H19NO3S/c1-3-4-10-13(19)18-16-15(17(20)21)14(11(2)22-16)12-8-6-5-7-9-12/h5-9H,3-4,10H2,1-2H3,(H,18,19)(H,20,21)