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

Systemtic Name: 3-(2-chloranyl-4-nitro-phenyl)sulfanyl-5-propan-2-yl-1H-1,2,4-triazole Openeye Name: 3-(2-chloro-4-nitro-phenyl)sulfanyl-5-isopropyl-1H-1,2,4-triazole CAS Name: 3-[(2-chloro-4-nitrophenyl)thio]-5-propan-2-yl-1H-1,2,4-triazole IUPAC Name: 3-(2-chloro-4-nitrophenyl)sulfanyl-5-propan-2-yl-1H-1,2,4-triazole Traditional Name: 3-[(2-chloro-4-nitro-phenyl)thio]-5-isopropyl-1H-1,2,4-triazole Formula: C11H11ClN4O2S MolecularWeight: 298.74864

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=NN1)SC2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)C1=NC(=NN1)SC2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C11H11ClN4O2S/c1-6(2)10-13-11(15-14-10)19-9-4-3-7(16(17)18)5-8(9)12/h3-6H,1-2H3,(H,13,14,15)