4-methyl-N-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)-3,5-dinitro-benzamide

Systemtic Name: 4-methyl-N-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)-3,5-dinitro-benzamide Openeye Name: 4-methyl-N-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)-3,5-dinitro-benzamide CAS Name: 4-methyl-N-[5-(methylthio)-1,3,4-thiadiazol-2-yl]-3,5-dinitrobenzamide IUPAC Name: 4-methyl-N-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)-3,5-dinitrobenzamide Traditional Name: 4-methyl-N-[5-(methylthio)-1,3,4-thiadiazol-2-yl]-3,5-dinitro-benzamide Formula: C11H9N5O5S2 MolecularWeight: 355.34966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])C(=O)NC2=NN=C(S2)SC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])C(=O)NC2=NN=C(S2)SC)[N+](=O)[O-]

InChI

InChI=1S/C11H9N5O5S2/c1-5-7(15(18)19)3-6(4-8(5)16(20)21)9(17)12-10-13-14-11(22-2)23-10/h3-4H,1-2H3,(H,12,13,17)