2-[[5-azanyl-2-(ethanoylsulfanylmethyl)pentanoyl]amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[5-azanyl-2-(ethanoylsulfanylmethyl)pentanoyl]amino]-3-phenyl-propanoic acid Openeye Name: 2-[[2-(acetylsulfanylmethyl)-5-amino-pentanoyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[2-[(acetylthio)methyl]-5-amino-1-oxopentyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[2-(acetylsulfanylmethyl)-5-aminopentanoyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[2-[(acetylthio)methyl]-5-amino-pentanoyl]amino]-3-phenyl-propionic acid Formula: C17H24N2O4S MolecularWeight: 352.44846

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(CCCN)C(=O)NC(CC1=CC=CC=C1)C(=O)O

Isomeric SMILES

CC(=O)SCC(CCCN)C(=O)NC(CC1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C17H24N2O4S/c1-12(20)24-11-14(8-5-9-18)16(21)19-15(17(22)23)10-13-6-3-2-4-7-13/h2-4,6-7,14-15H,5,8-11,18H2,1H3,(H,19,21)(H,22,23)