2-[[2-[[(1-azanyl-3-methylsulfanyl-propyl)-oxidanyl-phosphoryl]methyl]-3-phenyl-propanoyl]amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[2-[[(1-azanyl-3-methylsulfanyl-propyl)-oxidanyl-phosphoryl]methyl]-3-phenyl-propanoyl]amino]-3-phenyl-propanoic acid Openeye Name: 2-[[2-[[(1-amino-3-methylsulfanyl-propyl)-hydroxy-phosphoryl]methyl]-3-phenyl-propanoyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[2-[[[1-amino-3-(methylthio)propyl]-hydroxyphosphoryl]methyl]-1-oxo-3-phenylpropyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[2-[[(1-amino-3-methylsulfanylpropyl)-hydroxyphosphoryl]methyl]-3-phenylpropanoyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[2-[[[1-amino-3-(methylthio)propyl]-hydroxy-phosphoryl]methyl]-3-phenyl-propanoyl]amino]-3-phenyl-propionic acid Formula: C23H31N2O5PS MolecularWeight: 478.541401

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(N)P(=O)(CC(CC1=CC=CC=C1)C(=O)NC(CC2=CC=CC=C2)C(=O)O)O

Isomeric SMILES

CSCCC(N)P(=O)(CC(CC1=CC=CC=C1)C(=O)NC(CC2=CC=CC=C2)C(=O)O)O

InChI

InChI=1S/C23H31N2O5PS/c1-32-13-12-21(24)31(29,30)16-19(14-17-8-4-2-5-9-17)22(26)25-20(23(27)28)15-18-10-6-3-7-11-18/h2-11,19-21H,12-16,24H2,1H3,(H,25,26)(H,27,28)(H,29,30)