5-(phenylmethyl)-2-(propan-2-ylamino)thiophene-3-carboxylic acid

Systemtic Name: 5-(phenylmethyl)-2-(propan-2-ylamino)thiophene-3-carboxylic acid Openeye Name: 5-benzyl-2-(isopropylamino)thiophene-3-carboxylic acid CAS Name: 5-(phenylmethyl)-2-(propan-2-ylamino)-3-thiophenecarboxylic acid IUPAC Name: 5-benzyl-2-(propan-2-ylamino)thiophene-3-carboxylic acid Traditional Name: 5-benzyl-2-(isopropylamino)-3-thenoic acid Formula: C15H17NO2S MolecularWeight: 275.36598

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=C(C=C(S1)CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(C)NC1=C(C=C(S1)CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C15H17NO2S/c1-10(2)16-14-13(15(17)18)9-12(19-14)8-11-6-4-3-5-7-11/h3-7,9-10,16H,8H2,1-2H3,(H,17,18)