3-acetamido-6-azanyl-N-(2-hydroxyethyl)-2-methyl-4-oxidanylidene-5-[3-(pyridin-2-yldisulfanyl)propanoylamino]hexanamide

Systemtic Name: 3-acetamido-6-azanyl-N-(2-hydroxyethyl)-2-methyl-4-oxidanylidene-5-[3-(pyridin-2-yldisulfanyl)propanoylamino]hexanamide Openeye Name: 3-acetamido-6-amino-N-(2-hydroxyethyl)-2-methyl-4-oxo-5-[3-(2-pyridyldisulfanyl)propanoylamino]hexanamide CAS Name: 3-acetamido-6-amino-N-(2-hydroxyethyl)-2-methyl-4-oxo-5-[[1-oxo-3-(2-pyridinyldisulfanyl)propyl]amino]hexanamide IUPAC Name: 3-acetamido-6-amino-N-(2-hydroxyethyl)-2-methyl-4-oxo-5-[3-(pyridin-2-yldisulfanyl)propanoylamino]hexanamide Traditional Name: 3-acetamido-6-amino-N-(2-hydroxyethyl)-4-keto-2-methyl-5-[3-(2-pyridyldisulfanyl)propanoylamino]hexanamide Formula: C19H29N5O5S2 MolecularWeight: 471.59406

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)C(CN)NC(=O)CCSSC1=CC=CC=N1)NC(=O)C)C(=O)NCCO

Isomeric SMILES

CC(C(C(=O)C(CN)NC(=O)CCSSC1=CC=CC=N1)NC(=O)C)C(=O)NCCO

InChI

InChI=1S/C19H29N5O5S2/c1-12(19(29)22-8-9-25)17(23-13(2)26)18(28)14(11-20)24-15(27)6-10-30-31-16-5-3-4-7-21-16/h3-5,7,12,14,17,25H,6,8-11,20H2,1-2H3,(H,22,29)(H,23,26)(H,24,27)