tert-butyl (3S)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-oxidanylidene-5-(pyridin-3-ylmethylsulfanyl)pentanoate

Systemtic Name: tert-butyl (3S)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-oxidanylidene-5-(pyridin-3-ylmethylsulfanyl)pentanoate Openeye Name: tert-butyl (3S)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-oxo-5-(3-pyridylmethylsulfanyl)pentanoate CAS Name: (3S)-3-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-4-oxo-5-(3-pyridinylmethylthio)pentanoic acid tert-butyl ester IUPAC Name: tert-butyl (3S)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-oxo-5-(pyridin-3-ylmethylsulfanyl)pentanoate Traditional Name: (3S)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-keto-5-(3-pyridylmethylthio)valeric acid tert-butyl ester Formula: C30H32N2O5S MolecularWeight: 532.65048

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC(C(=O)CSCC1=CN=CC=C1)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

Isomeric SMILES

CC(C)(C)OC(=O)C[C@@H](C(=O)CSCC1=CN=CC=C1)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

InChI

InChI=1S/C30H32N2O5S/c1-30(2,3)37-28(34)15-26(27(33)19-38-18-20-9-8-14-31-16-20)32-29(35)36-17-25-23-12-6-4-10-21(23)22-11-5-7-13-24(22)25/h4-14,16,25-26H,15,17-19H2,1-3H3,(H,32,35)/t26-/m0/s1