3-(2-methoxy-4-nitro-phenyl)sulfanyl-5-(3-nitrophenyl)-1H-1,2,4-triazole

Systemtic Name: 3-(2-methoxy-4-nitro-phenyl)sulfanyl-5-(3-nitrophenyl)-1H-1,2,4-triazole Openeye Name: 3-(2-methoxy-4-nitro-phenyl)sulfanyl-5-(3-nitrophenyl)-1H-1,2,4-triazole CAS Name: 3-[(2-methoxy-4-nitrophenyl)thio]-5-(3-nitrophenyl)-1H-1,2,4-triazole IUPAC Name: 3-(2-methoxy-4-nitrophenyl)sulfanyl-5-(3-nitrophenyl)-1H-1,2,4-triazole Traditional Name: 3-[(2-methoxy-4-nitro-phenyl)thio]-5-(3-nitrophenyl)-1H-1,2,4-triazole Formula: C15H11N5O5S MolecularWeight: 373.34334

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])SC2=NNC(=N2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])SC2=NNC(=N2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H11N5O5S/c1-25-12-8-11(20(23)24)5-6-13(12)26-15-16-14(17-18-15)9-3-2-4-10(7-9)19(21)22/h2-8H,1H3,(H,16,17,18)