3-[butanoyl(ethyl)amino]-5-phenyl-thiophene-2-carboxylic acid

Systemtic Name: 3-[butanoyl(ethyl)amino]-5-phenyl-thiophene-2-carboxylic acid Openeye Name: 3-[butanoyl(ethyl)amino]-5-phenyl-thiophene-2-carboxylic acid CAS Name: 3-[ethyl(1-oxobutyl)amino]-5-phenyl-2-thiophenecarboxylic acid IUPAC Name: 3-[butanoyl(ethyl)amino]-5-phenylthiophene-2-carboxylic acid Traditional Name: 3-[butyryl(ethyl)amino]-5-phenyl-2-thenoic acid Formula: C17H19NO3S MolecularWeight: 317.40266

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N(CC)C1=C(SC(=C1)C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CCCC(=O)N(CC)C1=C(SC(=C1)C2=CC=CC=C2)C(=O)O

InChI

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