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

Systemtic Name: 3-(2-chloranyl-4-nitro-phenyl)sulfanyl-5-cyclopentyl-1H-1,2,4-triazole Openeye Name: 3-(2-chloro-4-nitro-phenyl)sulfanyl-5-cyclopentyl-1H-1,2,4-triazole CAS Name: 3-[(2-chloro-4-nitrophenyl)thio]-5-cyclopentyl-1H-1,2,4-triazole IUPAC Name: 3-(2-chloro-4-nitrophenyl)sulfanyl-5-cyclopentyl-1H-1,2,4-triazole Traditional Name: 3-[(2-chloro-4-nitro-phenyl)thio]-5-cyclopentyl-1H-1,2,4-triazole Formula: C13H13ClN4O2S MolecularWeight: 324.78592

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C2=NC(=NN2)SC3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1CCC(C1)C2=NC(=NN2)SC3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C13H13ClN4O2S/c14-10-7-9(18(19)20)5-6-11(10)21-13-15-12(16-17-13)8-3-1-2-4-8/h5-8H,1-4H2,(H,15,16,17)