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

Systemtic Name: 3-[(2-chloranylphenoxy)methyl]-5-[(2-methoxy-5-nitro-phenyl)methylsulfanyl]-4-methyl-1,2,4-triazole Openeye Name: 3-[(2-chlorophenoxy)methyl]-5-[(2-methoxy-5-nitro-phenyl)methylsulfanyl]-4-methyl-1,2,4-triazole CAS Name: 3-[(2-chlorophenoxy)methyl]-5-[(2-methoxy-5-nitrophenyl)methylthio]-4-methyl-1,2,4-triazole IUPAC Name: 3-[(2-chlorophenoxy)methyl]-5-[(2-methoxy-5-nitrophenyl)methylsulfanyl]-4-methyl-1,2,4-triazole Traditional Name: 3-[(2-chlorophenoxy)methyl]-5-[(2-methoxy-5-nitro-benzyl)thio]-4-methyl-1,2,4-triazole Formula: C18H17ClN4O4S MolecularWeight: 420.86998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=C(C=CC(=C2)[N+](=O)[O-])OC)COC3=CC=CC=C3Cl

Isomeric SMILES

CN1C(=NN=C1SCC2=C(C=CC(=C2)[N+](=O)[O-])OC)COC3=CC=CC=C3Cl

InChI

InChI=1S/C18H17ClN4O4S/c1-22-17(10-27-16-6-4-3-5-14(16)19)20-21-18(22)28-11-12-9-13(23(24)25)7-8-15(12)26-2/h3-9H,10-11H2,1-2H3