2-[4-[bis(2-azaniumylethylsulfanyl)arsanyl]-5-methyl-1,2-oxazol-3-yl]ethanesulfonate

Systemtic Name: 2-[4-[bis(2-azaniumylethylsulfanyl)arsanyl]-5-methyl-1,2-oxazol-3-yl]ethanesulfonate Openeye Name: 2-[4-[bis(2-azaniumylethylsulfanyl)arsanyl]-5-methyl-isoxazol-3-yl]ethanesulfonate CAS Name: 2-[4-bis(2-ammonioethylthio)arsino-5-methyl-3-isoxazolyl]ethanesulfonate IUPAC Name: 2-[4-[bis(2-azaniumylethylsulfanyl)arsanyl]-5-methyl-1,2-oxazol-3-yl]ethanesulfonate Traditional Name: 2-[4-bis(2-ammonioethylthio)arsino-5-methyl-isoxazol-3-yl]ethanesulfonate Formula: C10H21AsN3O4S3+ MolecularWeight: 418.40804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)CCS(=O)(=O)[O-])[As](SCC[NH3+])SCC[NH3+]

Isomeric SMILES

CC1=C(C(=NO1)CCS(=O)(=O)[O-])[As](SCC[NH3+])SCC[NH3+]

InChI

InChI=1S/C10H20AsN3O4S3/c1-8-10(11(19-5-3-12)20-6-4-13)9(14-18-8)2-7-21(15,16)17/h2-7,12-13H2,1H3,(H,15,16,17)/p+1