(Z)-[4-(2-acetamido-4-methylsulfanyl-butanoyl)piperazin-1-yl]-methoxyimino-oxidanidyl-azanium

Systemtic Name: (Z)-[4-(2-acetamido-4-methylsulfanyl-butanoyl)piperazin-1-yl]-methoxyimino-oxidanidyl-azanium Openeye Name: (Z)-[4-(2-acetamido-4-methylsulfanyl-butanoyl)piperazin-1-yl]-methoxyimino-oxido-ammonium CAS Name: (Z)-[4-[2-acetamido-4-(methylthio)-1-oxobutyl]-1-piperazinyl]-methoxyimino-oxidoammonium IUPAC Name: (Z)-[4-(2-acetamido-4-methylsulfanylbutanoyl)piperazin-1-yl]-methoxyimino-oxidoazanium Traditional Name: (Z)-[4-[2-acetamido-4-(methylthio)butanoyl]piperazino]-methyloximino-oxido-ammonium Formula: C12H23N5O4S MolecularWeight: 333.40712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CCSC)C(=O)N1CCN(CC1)[N+](=NOC)[O-]

Isomeric SMILES

CC(=O)NC(CCSC)C(=O)N1CCN(CC1)/[N+](=N/OC)/[O-]

InChI

InChI=1S/C12H23N5O4S/c1-10(18)13-11(4-9-22-3)12(19)15-5-7-16(8-6-15)17(20)14-21-2/h11H,4-9H2,1-3H3,(H,13,18)/b17-14-