1-oxidanidyl-4-propylsulfanyl-2,1,3-benzoxadiazol-1-ium

Systemtic Name: 1-oxidanidyl-4-propylsulfanyl-2,1,3-benzoxadiazol-1-ium Openeye Name: 1-oxido-4-propylsulfanyl-2,1,3-benzoxadiazol-1-ium CAS Name: 1-oxido-4-(propylthio)-2,1,3-benzoxadiazol-1-ium IUPAC Name: 1-oxido-4-propylsulfanyl-2,1,3-benzoxadiazol-1-ium Traditional Name: 1-oxido-4-(propylthio)benzofurazan-1-ium Formula: C9H10N2O2S MolecularWeight: 210.2529

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=CC=CC2=[N+](ON=C21)[O-]

Isomeric SMILES

CCCSC1=CC=CC2=[N+](ON=C21)[O-]

InChI

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