1-[2-[(1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl)amino]propanoyl]-3,3-bis(ethylsulfanyl)pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-[(1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl)amino]propanoyl]-3,3-bis(ethylsulfanyl)pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-[(1-ethoxycarbonyl-3-phenyl-propyl)amino]propanoyl]-3,3-bis(ethylsulfanyl)pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-1-oxopropyl]-3,3-bis(ethylthio)-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]propanoyl]-3,3-bis(ethylsulfanyl)pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[(1-carbethoxy-3-phenyl-propyl)amino]propanoyl]-3,3-bis(ethylthio)proline Formula: C24H36N2O5S2 MolecularWeight: 496.68304

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC1=CC=CC=C1)NC(C)C(=O)N2CCC(C2C(=O)O)(SCC)SCC

Isomeric SMILES

CCOC(=O)C(CCC1=CC=CC=C1)NC(C)C(=O)N2CCC(C2C(=O)O)(SCC)SCC

InChI

InChI=1S/C24H36N2O5S2/c1-5-31-23(30)19(14-13-18-11-9-8-10-12-18)25-17(4)21(27)26-16-15-24(32-6-2,33-7-3)20(26)22(28)29/h8-12,17,19-20,25H,5-7,13-16H2,1-4H3,(H,28,29)