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

Systemtic Name: N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]-4-methyl-3-nitro-benzamide Openeye Name: N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]-4-methyl-3-nitro-benzamide CAS Name: N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]-4-methyl-3-nitrobenzamide IUPAC Name: N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]-4-methyl-3-nitrobenzamide Traditional Name: N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]-4-methyl-3-nitro-benzamide Formula: C16H11ClN4O3S MolecularWeight: 374.80154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=NN=C(S2)C3=CC=CC=C3Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=NN=C(S2)C3=CC=CC=C3Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H11ClN4O3S/c1-9-6-7-10(8-13(9)21(23)24)14(22)18-16-20-19-15(25-16)11-4-2-3-5-12(11)17/h2-8H,1H3,(H,18,20,22)