2-[1-[4-methylsulfanyl-2-(phosphonoamino)butanoyl]pyrrolidin-2-yl]carbonyl-1-phenethyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 2-[1-[4-methylsulfanyl-2-(phosphonoamino)butanoyl]pyrrolidin-2-yl]carbonyl-1-phenethyl-pyrrolidine-2-carboxylic acid Openeye Name: 2-[1-[4-methylsulfanyl-2-(phosphonoamino)butanoyl]pyrrolidine-2-carbonyl]-1-phenethyl-pyrrolidine-2-carboxylic acid CAS Name: 2-[[1-[4-(methylthio)-1-oxo-2-(phosphonoamino)butyl]-2-pyrrolidinyl]-oxomethyl]-1-phenethyl-2-pyrrolidinecarboxylic acid IUPAC Name: 2-[1-[4-methylsulfanyl-2-(phosphonoamino)butanoyl]pyrrolidine-2-carbonyl]-1-phenethylpyrrolidine-2-carboxylic acid Traditional Name: 2-[1-[4-(methylthio)-2-(phosphonoamino)butanoyl]prolyl]-1-phenethyl-proline Formula: C23H34N3O7PS MolecularWeight: 527.570721

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)N1CCCC1C(=O)C2(CCCN2CCC3=CC=CC=C3)C(=O)O)NP(=O)(O)O

Isomeric SMILES

CSCCC(C(=O)N1CCCC1C(=O)C2(CCCN2CCC3=CC=CC=C3)C(=O)O)NP(=O)(O)O

InChI

InChI=1S/C23H34N3O7PS/c1-35-16-11-18(24-34(31,32)33)21(28)26-14-5-9-19(26)20(27)23(22(29)30)12-6-13-25(23)15-10-17-7-3-2-4-8-17/h2-4,7-8,18-19H,5-6,9-16H2,1H3,(H,29,30)(H3,24,31,32,33)