3-[(3-methoxyphenyl)methyl-propanoyl-amino]-5-phenyl-thiophene-2-carboxylic acid

Systemtic Name: 3-[(3-methoxyphenyl)methyl-propanoyl-amino]-5-phenyl-thiophene-2-carboxylic acid Openeye Name: 3-[(3-methoxyphenyl)methyl-propanoyl-amino]-5-phenyl-thiophene-2-carboxylic acid CAS Name: 3-[(3-methoxyphenyl)methyl-(1-oxopropyl)amino]-5-phenyl-2-thiophenecarboxylic acid IUPAC Name: 3-[(3-methoxyphenyl)methyl-propanoylamino]-5-phenylthiophene-2-carboxylic acid Traditional Name: 3-[m-anisyl(propionyl)amino]-5-phenyl-2-thenoic acid Formula: C22H21NO4S MolecularWeight: 395.47144

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(CC1=CC(=CC=C1)OC)C2=C(SC(=C2)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CCC(=O)N(CC1=CC(=CC=C1)OC)C2=C(SC(=C2)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C22H21NO4S/c1-3-20(24)23(14-15-8-7-11-17(12-15)27-2)18-13-19(28-21(18)22(25)26)16-9-5-4-6-10-16/h4-13H,3,14H2,1-2H3,(H,25,26)