2-[2-(2-azanylethanoylamino)ethanoyl-[2-(phenylcarbonylsulfanyl)propanoyl]amino]ethanoic acid

Systemtic Name: 2-[2-(2-azanylethanoylamino)ethanoyl-[2-(phenylcarbonylsulfanyl)propanoyl]amino]ethanoic acid Openeye Name: 2-[[2-[(2-aminoacetyl)amino]acetyl]-(2-benzoylsulfanylpropanoyl)amino]acetic acid CAS Name: 2-[[2-[(2-amino-1-oxoethyl)amino]-1-oxoethyl]-[2-(benzoylthio)-1-oxopropyl]amino]acetic acid IUPAC Name: 2-[[2-[(2-aminoacetyl)amino]acetyl]-(2-benzoylsulfanylpropanoyl)amino]acetic acid Traditional Name: 2-[2-(benzoylthio)propanoyl-[2-(glycylamino)acetyl]amino]acetic acid Formula: C16H19N3O6S MolecularWeight: 381.40356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(CC(=O)O)C(=O)CNC(=O)CN)SC(=O)C1=CC=CC=C1

Isomeric SMILES

CC(C(=O)N(CC(=O)O)C(=O)CNC(=O)CN)SC(=O)C1=CC=CC=C1

InChI

InChI=1S/C16H19N3O6S/c1-10(26-16(25)11-5-3-2-4-6-11)15(24)19(9-14(22)23)13(21)8-18-12(20)7-17/h2-6,10H,7-9,17H2,1H3,(H,18,20)(H,22,23)