3-chloranyl-N-oxidanyl-4-(pyrrolidin-1-ylcarbothioylsulfanylamino)cyclohexa-2,5-dien-1-imine oxide

Systemtic Name: 3-chloranyl-N-oxidanyl-4-(pyrrolidin-1-ylcarbothioylsulfanylamino)cyclohexa-2,5-dien-1-imine oxide Openeye Name: 3-chloro-N-hydroxy-4-(pyrrolidine-1-carbothioylsulfanylamino)cyclohexa-2,5-dien-1-imine oxide CAS Name: 3-chloro-N-hydroxy-4-[[[1-pyrrolidinyl(sulfanylidene)methyl]thio]amino]-1-cyclohexa-2,5-dienimine oxide IUPAC Name: 3-chloro-N-hydroxy-4-(pyrrolidine-1-carbothioylsulfanylamino)cyclohexa-2,5-dien-1-imine oxide Traditional Name: 3-chloro-N-hydroxy-4-[(pyrrolidine-1-carbothioylthio)amino]cyclohexa-2,5-dien-1-imine oxide Formula: C11H14ClN3O2S2 MolecularWeight: 319.83076

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=S)SNC2C=CC(=[N+](O)[O-])C=C2Cl

Isomeric SMILES

C1CCN(C1)C(=S)SNC2C=C/C(=[N+](\O)/[O-])/C=C2Cl

InChI

InChI=1S/C11H14ClN3O2S2/c12-9-7-8(15(16)17)3-4-10(9)13-19-11(18)14-5-1-2-6-14/h3-4,7,10,13H,1-2,5-6H2,(H,16,17)