2-[(3-ethanoylsulfanyl-2-methyl-propanoyl)-(4-propan-2-ylphenyl)amino]ethanoic acid

Systemtic Name: 2-[(3-ethanoylsulfanyl-2-methyl-propanoyl)-(4-propan-2-ylphenyl)amino]ethanoic acid Openeye Name: 2-(N-(3-acetylsulfanyl-2-methyl-propanoyl)-4-isopropyl-anilino)acetic acid CAS Name: 2-(N-[3-(acetylthio)-2-methyl-1-oxopropyl]-4-propan-2-ylanilino)acetic acid IUPAC Name: 2-(N-(3-acetylsulfanyl-2-methylpropanoyl)-4-propan-2-ylanilino)acetic acid Traditional Name: 2-(N-[3-(acetylthio)-2-methyl-propanoyl]-4-isopropyl-anilino)acetic acid Formula: C17H23NO4S MolecularWeight: 337.43382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N(CC(=O)O)C(=O)C(C)CSC(=O)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N(CC(=O)O)C(=O)C(C)CSC(=O)C

InChI

InChI=1S/C17H23NO4S/c1-11(2)14-5-7-15(8-6-14)18(9-16(20)21)17(22)12(3)10-23-13(4)19/h5-8,11-12H,9-10H2,1-4H3,(H,20,21)