5-azanyl-3-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propoxy]-4-(phenylcarbonyl)thiophene-2-carboxylic acid

Systemtic Name: 5-azanyl-3-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propoxy]-4-(phenylcarbonyl)thiophene-2-carboxylic acid Openeye Name: 5-amino-4-benzoyl-3-[3-(tert-butoxycarbonylamino)propoxy]thiophene-2-carboxylic acid CAS Name: 5-amino-4-benzoyl-3-[3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propoxy]-2-thiophenecarboxylic acid IUPAC Name: 5-amino-4-benzoyl-3-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propoxy]thiophene-2-carboxylic acid Traditional Name: 5-amino-4-benzoyl-3-[3-(tert-butoxycarbonylamino)propoxy]-2-thenoic acid Formula: C20H24N2O6S MolecularWeight: 420.47936

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCOC1=C(SC(=C1C(=O)C2=CC=CC=C2)N)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NCCCOC1=C(SC(=C1C(=O)C2=CC=CC=C2)N)C(=O)O

InChI

InChI=1S/C20H24N2O6S/c1-20(2,3)28-19(26)22-10-7-11-27-15-13(17(21)29-16(15)18(24)25)14(23)12-8-5-4-6-9-12/h4-6,8-9H,7,10-11,21H2,1-3H3,(H,22,26)(H,24,25)