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

Systemtic Name: 3-[ethyl(pentanoyl)amino]-5-phenyl-thiophene-2-carboxylic acid Openeye Name: 3-[ethyl(pentanoyl)amino]-5-phenyl-thiophene-2-carboxylic acid CAS Name: 3-[ethyl(1-oxopentyl)amino]-5-phenyl-2-thiophenecarboxylic acid IUPAC Name: 3-[ethyl(pentanoyl)amino]-5-phenylthiophene-2-carboxylic acid Traditional Name: 3-[ethyl(valeryl)amino]-5-phenyl-2-thenoic acid Formula: C18H21NO3S MolecularWeight: 331.42924

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21NO3S/c1-3-5-11-16(20)19(4-2)14-12-15(23-17(14)18(21)22)13-9-7-6-8-10-13/h6-10,12H,3-5,11H2,1-2H3,(H,21,22)