2-[3-[ethyl-(3-hydroxyphenyl)amino]-1-ethylsulfanyl-2-methyl-3-oxidanylidene-propyl]pyrrolidine-1-carboxylic acid

Systemtic Name: 2-[3-[ethyl-(3-hydroxyphenyl)amino]-1-ethylsulfanyl-2-methyl-3-oxidanylidene-propyl]pyrrolidine-1-carboxylic acid Openeye Name: 2-[3-(N-ethyl-3-hydroxy-anilino)-1-ethylsulfanyl-2-methyl-3-oxo-propyl]pyrrolidine-1-carboxylic acid CAS Name: 2-[3-(N-ethyl-3-hydroxyanilino)-1-(ethylthio)-2-methyl-3-oxopropyl]-1-pyrrolidinecarboxylic acid IUPAC Name: 2-[3-(N-ethyl-3-hydroxyanilino)-1-ethylsulfanyl-2-methyl-3-oxopropyl]pyrrolidine-1-carboxylic acid Traditional Name: 2-[3-(N-ethyl-3-hydroxy-anilino)-1-(ethylthio)-3-keto-2-methyl-propyl]pyrrolidine-1-carboxylic acid Formula: C19H28N2O4S MolecularWeight: 380.50162

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC(=CC=C1)O)C(=O)C(C)C(C2CCCN2C(=O)O)SCC

Isomeric SMILES

CCN(C1=CC(=CC=C1)O)C(=O)C(C)C(C2CCCN2C(=O)O)SCC

InChI

InChI=1S/C19H28N2O4S/c1-4-20(14-8-6-9-15(22)12-14)18(23)13(3)17(26-5-2)16-10-7-11-21(16)19(24)25/h6,8-9,12-13,16-17,22H,4-5,7,10-11H2,1-3H3,(H,24,25)