(2S)-2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylsulfanyl-butanoyl]amino]pentanedioate

Systemtic Name: (2S)-2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylsulfanyl-butanoyl]amino]pentanedioate Openeye Name: (2S)-2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylsulfanyl-butanoyl]amino]pentanedioate CAS Name: (2S)-2-[[(2S)-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-4-(methylthio)-1-oxobutyl]amino]pentanedioate IUPAC Name: (2S)-2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylsulfanylbutanoyl]amino]pentanedioate Traditional Name: (2S)-2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-(methylthio)butanoyl]amino]glutarate Formula: C25H26N2O7S-2 MolecularWeight: 498.54814

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NC(CCC(=O)[O-])C(=O)[O-])NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13

Isomeric SMILES

CSCC[C@@H](C(=O)N[C@@H](CCC(=O)[O-])C(=O)[O-])NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13

InChI

InChI=1S/C25H28N2O7S/c1-35-13-12-20(23(30)26-21(24(31)32)10-11-22(28)29)27-25(33)34-14-19-17-8-4-2-6-15(17)16-7-3-5-9-18(16)19/h2-9,19-21H,10-14H2,1H3,(H,26,30)(H,27,33)(H,28,29)(H,31,32)/p-2/t20-,21-/m0/s1