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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NN=C(S2)NC(=O)C3=C(C=CC(=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1C2=NN=C(S2)NC(=O)C3=C(C=CC(=C3)Cl)[N+](=O)[O-]

InChI

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