2-(carboxymethyl)-3-methyl-2-(2-phenylethanoylamino)-3H-thiophene-4-carboxylic acid

Systemtic Name: 2-(carboxymethyl)-3-methyl-2-(2-phenylethanoylamino)-3H-thiophene-4-carboxylic acid Openeye Name: 2-(carboxymethyl)-3-methyl-2-[(2-phenylacetyl)amino]-3H-thiophene-4-carboxylic acid CAS Name: 2-(carboxymethyl)-3-methyl-2-[(1-oxo-2-phenylethyl)amino]-3H-thiophene-4-carboxylic acid IUPAC Name: 2-(carboxymethyl)-3-methyl-2-[(2-phenylacetyl)amino]-3H-thiophene-4-carboxylic acid Traditional Name: 2-(carboxymethyl)-3-methyl-2-[(2-phenylacetyl)amino]-3H-thiophene-4-carboxylic acid Formula: C16H17NO5S MolecularWeight: 335.37488

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=CSC1(CC(=O)O)NC(=O)CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC1C(=CSC1(CC(=O)O)NC(=O)CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C16H17NO5S/c1-10-12(15(21)22)9-23-16(10,8-14(19)20)17-13(18)7-11-5-3-2-4-6-11/h2-6,9-10H,7-8H2,1H3,(H,17,18)(H,19,20)(H,21,22)