2-[[2-benzamido-3-(phenylcarbonylsulfanyl)propanoyl]amino]ethanoic acid

Systemtic Name: 2-[[2-benzamido-3-(phenylcarbonylsulfanyl)propanoyl]amino]ethanoic acid Openeye Name: 2-[(2-benzamido-3-benzoylsulfanyl-propanoyl)amino]acetic acid CAS Name: 2-[[2-benzamido-3-(benzoylthio)-1-oxopropyl]amino]acetic acid IUPAC Name: 2-[(2-benzamido-3-benzoylsulfanylpropanoyl)amino]acetic acid Traditional Name: 2-[[2-benzamido-3-(benzoylthio)propanoyl]amino]acetic acid Formula: C19H18N2O5S MolecularWeight: 386.42162

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(CSC(=O)C2=CC=CC=C2)C(=O)NCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC(CSC(=O)C2=CC=CC=C2)C(=O)NCC(=O)O

InChI

InChI=1S/C19H18N2O5S/c22-16(23)11-20-18(25)15(21-17(24)13-7-3-1-4-8-13)12-27-19(26)14-9-5-2-6-10-14/h1-10,15H,11-12H2,(H,20,25)(H,21,24)(H,22,23)