3-(furan-2-yl)-5-[(2-methoxy-5-nitro-phenyl)methylsulfanyl]-4-methyl-1,2,4-triazole

Systemtic Name: 3-(furan-2-yl)-5-[(2-methoxy-5-nitro-phenyl)methylsulfanyl]-4-methyl-1,2,4-triazole Openeye Name: 3-(2-furyl)-5-[(2-methoxy-5-nitro-phenyl)methylsulfanyl]-4-methyl-1,2,4-triazole CAS Name: 3-(2-furanyl)-5-[(2-methoxy-5-nitrophenyl)methylthio]-4-methyl-1,2,4-triazole IUPAC Name: 3-(furan-2-yl)-5-[(2-methoxy-5-nitrophenyl)methylsulfanyl]-4-methyl-1,2,4-triazole Traditional Name: 3-(2-furyl)-5-[(2-methoxy-5-nitro-benzyl)thio]-4-methyl-1,2,4-triazole Formula: C15H14N4O4S MolecularWeight: 346.36106

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=C(C=CC(=C2)[N+](=O)[O-])OC)C3=CC=CO3

Isomeric SMILES

CN1C(=NN=C1SCC2=C(C=CC(=C2)[N+](=O)[O-])OC)C3=CC=CO3

InChI

InChI=1S/C15H14N4O4S/c1-18-14(13-4-3-7-23-13)16-17-15(18)24-9-10-8-11(19(20)21)5-6-12(10)22-2/h3-8H,9H2,1-2H3