2-(2-nitroimidazol-1-yl)-2-[2-(2-sulfanylethylsulfanyl)ethanoylamino]butanamide

Systemtic Name: 2-(2-nitroimidazol-1-yl)-2-[2-(2-sulfanylethylsulfanyl)ethanoylamino]butanamide Openeye Name: 2-(2-nitroimidazol-1-yl)-2-[[2-(2-sulfanylethylsulfanyl)acetyl]amino]butanamide CAS Name: 2-[[2-(2-mercaptoethylthio)-1-oxoethyl]amino]-2-(2-nitro-1-imidazolyl)butanamide IUPAC Name: 2-(2-nitroimidazol-1-yl)-2-[[2-(2-sulfanylethylsulfanyl)acetyl]amino]butanamide Traditional Name: 2-[[2-(2-mercaptoethylthio)acetyl]amino]-2-(2-nitroimidazol-1-yl)butyramide Formula: C11H17N5O4S2 MolecularWeight: 347.41378

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N)(NC(=O)CSCCS)N1C=CN=C1[N+](=O)[O-]

Isomeric SMILES

CCC(C(=O)N)(NC(=O)CSCCS)N1C=CN=C1[N+](=O)[O-]

InChI

InChI=1S/C11H17N5O4S2/c1-2-11(9(12)18,14-8(17)7-22-6-5-21)15-4-3-13-10(15)16(19)20/h3-4,21H,2,5-7H2,1H3,(H2,12,18)(H,14,17)