tert-butyl N-[(3R)-5-ethylsulfanyl-2-oxidanyl-1-oxidanylidene-1-(4-phenylbutanoylamino)pentan-3-yl]carbamate

Systemtic Name: tert-butyl N-[(3R)-5-ethylsulfanyl-2-oxidanyl-1-oxidanylidene-1-(4-phenylbutanoylamino)pentan-3-yl]carbamate Openeye Name: tert-butyl N-[(1R)-1-(2-ethylsulfanylethyl)-2-hydroxy-3-oxo-3-(4-phenylbutanoylamino)propyl]carbamate CAS Name: N-[(3R)-5-(ethylthio)-2-hydroxy-1-oxo-1-[(1-oxo-4-phenylbutyl)amino]pentan-3-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(3R)-5-ethylsulfanyl-2-hydroxy-1-oxo-1-(4-phenylbutanoylamino)pentan-3-yl]carbamate Traditional Name: N-[(1R)-1-[2-(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:

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

Isomeric SMILES

CCSCC[C@H](C(C(=O)NC(=O)CCCC1=CC=CC=C1)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C22H34N2O5S/c1-5-30-15-14-17(23-21(28)29-22(2,3)4)19(26)20(27)24-18(25)13-9-12-16-10-7-6-8-11-16/h6-8,10-11,17,19,26H,5,9,12-15H2,1-4H3,(H,23,28)(H,24,25,27)/t17-,19?/m1/s1