2-cyano-N-ethyl-5-[[5-(ethylcarbamoyl)-6-isocyano-1-oxidanidyl-pyridin-1-ium-3-yl]disulfanyl]-1-oxidanidyl-pyridin-1-ium-3-carboxamide

Systemtic Name: 2-cyano-N-ethyl-5-[[5-(ethylcarbamoyl)-6-isocyano-1-oxidanidyl-pyridin-1-ium-3-yl]disulfanyl]-1-oxidanidyl-pyridin-1-ium-3-carboxamide Openeye Name: 2-cyano-N-ethyl-5-[[5-(ethylcarbamoyl)-6-isocyano-1-oxido-pyridin-1-ium-3-yl]disulfanyl]-1-oxido-pyridin-1-ium-3-carboxamide CAS Name: 2-cyano-N-ethyl-5-[[5-(ethylcarbamoyl)-6-isocyano-1-oxido-3-pyridin-1-iumyl]disulfanyl]-1-oxido-3-pyridin-1-iumcarboxamide IUPAC Name: 2-cyano-N-ethyl-5-[[5-(ethylcarbamoyl)-6-isocyano-1-oxidopyridin-1-ium-3-yl]disulfanyl]-1-oxidopyridin-1-ium-3-carboxamide Traditional Name: 2-cyano-N-ethyl-5-[[5-(ethylcarbamoyl)-6-isocyano-1-oxido-pyridin-1-ium-3-yl]disulfanyl]-1-oxido-pyridin-1-ium-3-carboxamide Formula: C18H16N6O4S2 MolecularWeight: 444.48744

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC(=C[N+](=C1C#N)[O-])SSC2=C[N+](=C(C(=C2)C(=O)NCC)[N+]#[C-])[O-]

Isomeric SMILES

CCNC(=O)C1=CC(=C[N+](=C1C#N)[O-])SSC2=C[N+](=C(C(=C2)C(=O)NCC)[N+]#[C-])[O-]

InChI

InChI=1S/C18H16N6O4S2/c1-4-21-17(25)13-6-11(9-23(27)15(13)8-19)29-30-12-7-14(18(26)22-5-2)16(20-3)24(28)10-12/h6-7,9-10H,4-5H2,1-2H3,(H,21,25)(H,22,26)