[1-[[(2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]-3-methylsulfanyl-propyl]phosphonous acid

Systemtic Name: [1-[[(2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]-3-methylsulfanyl-propyl]phosphonous acid Openeye Name: [1-[[(2S)-2-(benzyloxycarbonylamino)-3-methyl-butanoyl]amino]-3-methylsulfanyl-propyl]phosphonous acid CAS Name: [1-[[(2S)-3-methyl-1-oxo-2-(phenylmethoxycarbonylamino)butyl]amino]-3-(methylthio)propyl]phosphonous acid IUPAC Name: [1-[[(2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]-3-methylsulfanylpropyl]phosphonous acid Traditional Name: [1-[[(2S)-2-(benzyloxycarbonylamino)-3-methyl-butanoyl]amino]-3-(methylthio)propyl]phosphonous acid Formula: C17H27N2O5PS MolecularWeight: 402.445441

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(CCSC)P(O)O)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC(C)[C@@H](C(=O)NC(CCSC)P(O)O)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C17H27N2O5PS/c1-12(2)15(16(20)18-14(25(22)23)9-10-26-3)19-17(21)24-11-13-7-5-4-6-8-13/h4-8,12,14-15,22-23H,9-11H2,1-3H3,(H,18,20)(H,19,21)/t14?,15-/m0/s1