methyl 4-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methyl-2-pyridin-2-ylsulfanyl-pentanoate

Systemtic Name: methyl 4-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methyl-2-pyridin-2-ylsulfanyl-pentanoate Openeye Name: methyl 4-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methyl-2-(2-pyridylsulfanyl)pentanoate CAS Name: 4-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-4-methyl-2-(2-pyridinylthio)pentanoic acid methyl ester IUPAC Name: methyl 4-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methyl-2-pyridin-2-ylsulfanylpentanoate Traditional Name: 4-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methyl-2-(2-pyridylthio)valeric acid methyl ester Formula: C27H28N2O4S MolecularWeight: 476.58722

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(C(=O)OC)SC1=CC=CC=N1)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

Isomeric SMILES

CC(C)(CC(C(=O)OC)SC1=CC=CC=N1)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

InChI

InChI=1S/C27H28N2O4S/c1-27(2,16-23(25(30)32-3)34-24-14-8-9-15-28-24)29-26(31)33-17-22-20-12-6-4-10-18(20)19-11-5-7-13-21(19)22/h4-15,22-23H,16-17H2,1-3H3,(H,29,31)