2-acetamido-3-[(2-acetamido-3-oxidanyl-3-oxidanylidene-propyl)sulfanyl-[4-(aminocarbonylamino)phenyl]arsanyl]sulfanyl-propanoic acid

Systemtic Name: 2-acetamido-3-[(2-acetamido-3-oxidanyl-3-oxidanylidene-propyl)sulfanyl-[4-(aminocarbonylamino)phenyl]arsanyl]sulfanyl-propanoic acid Openeye Name: 2-acetamido-3-[(2-acetamido-3-hydroxy-3-oxo-propyl)sulfanyl-(4-ureidophenyl)arsanyl]sulfanyl-propanoic acid CAS Name: 2-acetamido-3-[[[(2-acetamido-3-hydroxy-3-oxopropyl)thio]-[4-(carbamoylamino)phenyl]arsino]thio]propanoic acid IUPAC Name: 2-acetamido-3-[(2-acetamido-3-hydroxy-3-oxopropyl)sulfanyl-[4-(carbamoylamino)phenyl]arsanyl]sulfanylpropanoic acid Traditional Name: 2-acetamido-3-[[[(2-acetamido-3-hydroxy-3-keto-propyl)thio]-(4-ureidophenyl)arsino]thio]propionic acid Formula: C17H23AsN4O7S2 MolecularWeight: 534.43872

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CS[As](C1=CC=C(C=C1)NC(=O)N)SCC(C(=O)O)NC(=O)C)C(=O)O

Isomeric SMILES

CC(=O)NC(CS[As](C1=CC=C(C=C1)NC(=O)N)SCC(C(=O)O)NC(=O)C)C(=O)O

InChI

InChI=1S/C17H23AsN4O7S2/c1-9(23)20-13(15(25)26)7-30-18(31-8-14(16(27)28)21-10(2)24)11-3-5-12(6-4-11)22-17(19)29/h3-6,13-14H,7-8H2,1-2H3,(H,20,23)(H,21,24)(H,25,26)(H,27,28)(H3,19,22,29)