2-[bis(butylsulfanyl)phosphinothioylmethyl-phenylmethoxycarbonyl-amino]-4-ethoxy-butanoic acid

Systemtic Name: 2-[bis(butylsulfanyl)phosphinothioylmethyl-phenylmethoxycarbonyl-amino]-4-ethoxy-butanoic acid Openeye Name: 2-[benzyloxycarbonyl-[bis(butylsulfanyl)phosphinothioylmethyl]amino]-4-ethoxy-butanoic acid CAS Name: 2-[bis(butylthio)phosphinothioylmethyl-phenylmethoxycarbonylamino]-4-ethoxybutanoic acid IUPAC Name: 2-[bis(butylsulfanyl)phosphinothioylmethyl-phenylmethoxycarbonylamino]-4-ethoxybutanoic acid Traditional Name: 2-[bis(butylthio)thiophosphorylmethyl-carbobenzoxy-amino]-4-ethoxy-butyric acid Formula: C23H38NO5PS3 MolecularWeight: 535.720281

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSP(=S)(CN(C(CCOCC)C(=O)O)C(=O)OCC1=CC=CC=C1)SCCCC

Isomeric SMILES

CCCCSP(=S)(CN(C(CCOCC)C(=O)O)C(=O)OCC1=CC=CC=C1)SCCCC

InChI

InChI=1S/C23H38NO5PS3/c1-4-7-16-32-30(31,33-17-8-5-2)19-24(21(22(25)26)14-15-28-6-3)23(27)29-18-20-12-10-9-11-13-20/h9-13,21H,4-8,14-19H2,1-3H3,(H,25,26)