tert-butyl N-[4-ethylsulfanyl-2-oxidanyl-1-oxidanylidene-1-(4-phenylbutanoylamino)pentan-3-yl]carbamate

Systemtic Name: tert-butyl N-[4-ethylsulfanyl-2-oxidanyl-1-oxidanylidene-1-(4-phenylbutanoylamino)pentan-3-yl]carbamate Openeye Name: tert-butyl N-[1-(1-ethylsulfanylethyl)-2-hydroxy-3-oxo-3-(4-phenylbutanoylamino)propyl]carbamate CAS Name: N-[4-(ethylthio)-2-hydroxy-1-oxo-1-[(1-oxo-4-phenylbutyl)amino]pentan-3-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-ethylsulfanyl-2-hydroxy-1-oxo-1-(4-phenylbutanoylamino)pentan-3-yl]carbamate Traditional Name: N-[1-[1-(ethylthio)ethyl]-2-hydroxy-3-keto-3-(4-phenylbutanoylamino)propyl]carbamic acid tert-butyl ester Formula: C22H34N2O5S MolecularWeight: 438.58076

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(C)C(C(C(=O)NC(=O)CCCC1=CC=CC=C1)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CCSC(C)C(C(C(=O)NC(=O)CCCC1=CC=CC=C1)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C22H34N2O5S/c1-6-30-15(2)18(24-21(28)29-22(3,4)5)19(26)20(27)23-17(25)14-10-13-16-11-8-7-9-12-16/h7-9,11-12,15,18-19,26H,6,10,13-14H2,1-5H3,(H,24,28)(H,23,25,27)