(4S)-4-[[4-methylsulfanyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]-5-oxidanylidene-5-phenylmethoxy-pentanoic acid

Systemtic Name: (4S)-4-[[4-methylsulfanyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]-5-oxidanylidene-5-phenylmethoxy-pentanoic acid Openeye Name: (4S)-5-benzyloxy-4-[[2-(benzyloxycarbonylamino)-4-methylsulfanyl-butanoyl]amino]-5-oxo-pentanoic acid CAS Name: (4S)-4-[[4-(methylthio)-1-oxo-2-(phenylmethoxycarbonylamino)butyl]amino]-5-oxo-5-phenylmethoxypentanoic acid IUPAC Name: (4S)-4-[[4-methylsulfanyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]-5-oxo-5-phenylmethoxypentanoic acid Traditional Name: (4S)-5-benzoxy-4-[[2-(benzyloxycarbonylamino)-4-(methylthio)butanoyl]amino]-5-keto-valeric acid Formula: C25H30N2O7S MolecularWeight: 502.5799

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NC(CCC(=O)O)C(=O)OCC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CSCCC(C(=O)N[C@@H](CCC(=O)O)C(=O)OCC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C25H30N2O7S/c1-35-15-14-20(27-25(32)34-17-19-10-6-3-7-11-19)23(30)26-21(12-13-22(28)29)24(31)33-16-18-8-4-2-5-9-18/h2-11,20-21H,12-17H2,1H3,(H,26,30)(H,27,32)(H,28,29)/t20?,21-/m0/s1