N-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]-2-nitro-benzamide

Systemtic Name: N-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]-2-nitro-benzamide Openeye Name: 2-nitro-N-[5-(p-tolyl)-1,3,4-thiadiazol-2-yl]benzamide CAS Name: N-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]-2-nitrobenzamide IUPAC Name: N-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]-2-nitrobenzamide Traditional Name: 2-nitro-N-[5-(p-tolyl)-1,3,4-thiadiazol-2-yl]benzamide Formula: C16H12N4O3S MolecularWeight: 340.35648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(S2)NC(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(S2)NC(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C16H12N4O3S/c1-10-6-8-11(9-7-10)15-18-19-16(24-15)17-14(21)12-4-2-3-5-13(12)20(22)23/h2-9H,1H3,(H,17,19,21)