3-oxidanidyl-5-propylsulfanyl-2,1,3-benzoxadiazol-3-ium

Systemtic Name: 3-oxidanidyl-5-propylsulfanyl-2,1,3-benzoxadiazol-3-ium Openeye Name: 3-oxido-5-propylsulfanyl-2,1,3-benzoxadiazol-3-ium CAS Name: 3-oxido-5-(propylthio)-2,1,3-benzoxadiazol-3-ium IUPAC Name: 3-oxido-5-propylsulfanyl-2,1,3-benzoxadiazol-3-ium Traditional Name: 1-oxido-6-(propylthio)benzofurazan-1-ium Formula: C9H10N2O2S MolecularWeight: 210.2529

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=CC2=[N+](ON=C2C=C1)[O-]

Isomeric SMILES

CCCSC1=CC2=[N+](ON=C2C=C1)[O-]

InChI

InChI=1S/C9H10N2O2S/c1-2-5-14-7-3-4-8-9(6-7)11(12)13-10-8/h3-4,6H,2,5H2,1H3