S-(4-methylphenyl) (2S,3S)-2-azanyl-3-(9H-fluoren-9-ylmethoxycarbonylamino)-5-methyl-hexanethioate

Systemtic Name: S-(4-methylphenyl) (2S,3S)-2-azanyl-3-(9H-fluoren-9-ylmethoxycarbonylamino)-5-methyl-hexanethioate Openeye Name: S-(p-tolyl) (2S,3S)-2-amino-3-(9H-fluoren-9-ylmethoxycarbonylamino)-5-methyl-hexanethioate CAS Name: (2S,3S)-2-amino-3-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-5-methylhexanethioic acid S-(4-methylphenyl) ester IUPAC Name: S-(4-methylphenyl) (2S,3S)-2-amino-3-(9H-fluoren-9-ylmethoxycarbonylamino)-5-methylhexanethioate Traditional Name: (2S,3S)-2-amino-3-(9H-fluoren-9-ylmethoxycarbonylamino)-5-methyl-hexanethioic acid S-(p-tolyl) ester Formula: C29H32N2O3S MolecularWeight: 488.64098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(=O)C(C(CC(C)C)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)N

Isomeric SMILES

CC1=CC=C(C=C1)SC(=O)[C@H]([C@H](CC(C)C)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)N

InChI

InChI=1S/C29H32N2O3S/c1-18(2)16-26(27(30)28(32)35-20-14-12-19(3)13-15-20)31-29(33)34-17-25-23-10-6-4-8-21(23)22-9-5-7-11-24(22)25/h4-15,18,25-27H,16-17,30H2,1-3H3,(H,31,33)/t26-,27-/m0/s1