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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC2=C(C=C(C=C2)[N+](=O)[O-])Cl)C3CC3

Isomeric SMILES

CCN1C(=NN=C1SC2=C(C=C(C=C2)[N+](=O)[O-])Cl)C3CC3

InChI

InChI=1S/C13H13ClN4O2S/c1-2-17-12(8-3-4-8)15-16-13(17)21-11-6-5-9(18(19)20)7-10(11)14/h5-8H,2-4H2,1H3