2-[(3-methylsulfanyl-1,2,4-thiadiazol-5-yl)sulfanyl]-N-(5-nitro-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2-[(3-methylsulfanyl-1,2,4-thiadiazol-5-yl)sulfanyl]-N-(5-nitro-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-[(3-methylsulfanyl-1,2,4-thiadiazol-5-yl)sulfanyl]-N-(5-nitro-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-[[3-(methylthio)-1,2,4-thiadiazol-5-yl]thio]-N-(5-nitro-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-[(3-methylsulfanyl-1,2,4-thiadiazol-5-yl)sulfanyl]-N-(5-nitro-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-[[3-(methylthio)-1,2,4-thiadiazol-5-yl]thio]-N-(5-nitro-1,3-benzothiazol-2-yl)acetamide Formula: C12H9N5O3S4 MolecularWeight: 399.49156

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NSC(=N1)SCC(=O)NC2=NC3=C(S2)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CSC1=NSC(=N1)SCC(=O)NC2=NC3=C(S2)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C12H9N5O3S4/c1-21-11-15-12(24-16-11)22-5-9(18)14-10-13-7-4-6(17(19)20)2-3-8(7)23-10/h2-4H,5H2,1H3,(H,13,14,18)