3-(5-chloranyl-2-nitro-phenyl)sulfanyl-4-methyl-1,2,4-triazole

Systemtic Name: 3-(5-chloranyl-2-nitro-phenyl)sulfanyl-4-methyl-1,2,4-triazole Openeye Name: 3-(5-chloro-2-nitro-phenyl)sulfanyl-4-methyl-1,2,4-triazole CAS Name: 3-[(5-chloro-2-nitrophenyl)thio]-4-methyl-1,2,4-triazole IUPAC Name: 3-(5-chloro-2-nitrophenyl)sulfanyl-4-methyl-1,2,4-triazole Traditional Name: 3-[(5-chloro-2-nitro-phenyl)thio]-4-methyl-1,2,4-triazole Formula: C9H7ClN4O2S MolecularWeight: 270.69548

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SC2=C(C=CC(=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CN1C=NN=C1SC2=C(C=CC(=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C9H7ClN4O2S/c1-13-5-11-12-9(13)17-8-4-6(10)2-3-7(8)14(15)16/h2-5H,1H3