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

Systemtic Name: 3-(4-ethylsulfonyl-2-nitro-phenyl)sulfanyl-4-methyl-1,2,4-triazole Openeye Name: 3-(4-ethylsulfonyl-2-nitro-phenyl)sulfanyl-4-methyl-1,2,4-triazole CAS Name: 3-[(4-ethylsulfonyl-2-nitrophenyl)thio]-4-methyl-1,2,4-triazole IUPAC Name: 3-(4-ethylsulfonyl-2-nitrophenyl)sulfanyl-4-methyl-1,2,4-triazole Traditional Name: 3-[(4-esyl-2-nitro-phenyl)thio]-4-methyl-1,2,4-triazole Formula: C11H12N4O4S2 MolecularWeight: 328.36738

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC(=C(C=C1)SC2=NN=CN2C)[N+](=O)[O-]

Isomeric SMILES

CCS(=O)(=O)C1=CC(=C(C=C1)SC2=NN=CN2C)[N+](=O)[O-]

InChI

InChI=1S/C11H12N4O4S2/c1-3-21(18,19)8-4-5-10(9(6-8)15(16)17)20-11-13-12-7-14(11)2/h4-7H,3H2,1-2H3