5-methyl-2-(4-thiophen-2-ylbutanoylamino)benzoic acid

Systemtic Name: 5-methyl-2-(4-thiophen-2-ylbutanoylamino)benzoic acid Openeye Name: 5-methyl-2-[4-(2-thienyl)butanoylamino]benzoic acid CAS Name: 5-methyl-2-[(1-oxo-4-thiophen-2-ylbutyl)amino]benzoic acid IUPAC Name: 5-methyl-2-(4-thiophen-2-ylbutanoylamino)benzoic acid Traditional Name: 5-methyl-2-[4-(2-thienyl)butanoylamino]benzoic acid Formula: C16H17NO3S MolecularWeight: 303.37608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CCCC2=CC=CS2)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CCCC2=CC=CS2)C(=O)O

InChI

InChI=1S/C16H17NO3S/c1-11-7-8-14(13(10-11)16(19)20)17-15(18)6-2-4-12-5-3-9-21-12/h3,5,7-10H,2,4,6H2,1H3,(H,17,18)(H,19,20)