tert-butyl N-[5-oxidanylidene-5-[[3-oxidanylidene-1-(phenylmethylsulfanyl)butan-2-yl]amino]pentan-2-yl]carbamate

Systemtic Name: tert-butyl N-[5-oxidanylidene-5-[[3-oxidanylidene-1-(phenylmethylsulfanyl)butan-2-yl]amino]pentan-2-yl]carbamate Openeye Name: tert-butyl N-[4-[[1-(benzylsulfanylmethyl)-2-oxo-propyl]amino]-1-methyl-4-oxo-butyl]carbamate CAS Name: N-[5-oxo-5-[[3-oxo-1-(phenylmethylthio)butan-2-yl]amino]pentan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[5-[(1-benzylsulfanyl-3-oxobutan-2-yl)amino]-5-oxopentan-2-yl]carbamate Traditional Name: N-[4-[[1-[(benzylthio)methyl]-2-keto-propyl]amino]-4-keto-1-methyl-butyl]carbamic acid tert-butyl ester Formula: C21H32N2O4S MolecularWeight: 408.55478

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(=O)NC(CSCC1=CC=CC=C1)C(=O)C)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(CCC(=O)NC(CSCC1=CC=CC=C1)C(=O)C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C21H32N2O4S/c1-15(22-20(26)27-21(3,4)5)11-12-19(25)23-18(16(2)24)14-28-13-17-9-7-6-8-10-17/h6-10,15,18H,11-14H2,1-5H3,(H,22,26)(H,23,25)