N-[3-(2-azanyl-2-oxidanylidene-ethyl)-5-nitro-1,3-thiazol-2-ylidene]-3-nitro-benzamide

Systemtic Name: N-[3-(2-azanyl-2-oxidanylidene-ethyl)-5-nitro-1,3-thiazol-2-ylidene]-3-nitro-benzamide Openeye Name: N-[3-(2-amino-2-oxo-ethyl)-5-nitro-thiazol-2-ylidene]-3-nitro-benzamide CAS Name: N-[3-(2-amino-2-oxoethyl)-5-nitro-2-thiazolylidene]-3-nitrobenzamide IUPAC Name: N-[3-(2-amino-2-oxoethyl)-5-nitro-1,3-thiazol-2-ylidene]-3-nitrobenzamide Traditional Name: N-[3-(2-amino-2-keto-ethyl)-5-nitro-4-thiazolin-2-ylidene]-3-nitro-benzamide Formula: C12H9N5O6S MolecularWeight: 351.29476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)N=C2N(C=C(S2)[N+](=O)[O-])CC(=O)N

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)N=C2N(C=C(S2)[N+](=O)[O-])CC(=O)N

InChI

InChI=1S/C12H9N5O6S/c13-9(18)5-15-6-10(17(22)23)24-12(15)14-11(19)7-2-1-3-8(4-7)16(20)21/h1-4,6H,5H2,(H2,13,18)