5-(3-methyl-4-nitro-phenyl)-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-(3-methyl-4-nitro-phenyl)-1,3,4-thiadiazol-2-amine Openeye Name: 5-(3-methyl-4-nitro-phenyl)-1,3,4-thiadiazol-2-amine CAS Name: 5-(3-methyl-4-nitrophenyl)-1,3,4-thiadiazol-2-amine IUPAC Name: 5-(3-methyl-4-nitrophenyl)-1,3,4-thiadiazol-2-amine Traditional Name: [5-(3-methyl-4-nitro-phenyl)-1,3,4-thiadiazol-2-yl]amine Formula: C9H8N4O2S MolecularWeight: 236.25042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=NN=C(S2)N)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C2=NN=C(S2)N)[N+](=O)[O-]

InChI

InChI=1S/C9H8N4O2S/c1-5-4-6(2-3-7(5)13(14)15)8-11-12-9(10)16-8/h2-4H,1H3,(H2,10,12)