3-[5-[(5-bromanyl-2-methoxy-phenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]pyridine

Systemtic Name: 3-[5-[(5-bromanyl-2-methoxy-phenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]pyridine Openeye Name: 3-[5-[(5-bromo-2-methoxy-phenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]pyridine CAS Name: 3-[5-[(5-bromo-2-methoxyphenyl)methylthio]-4-methyl-1,2,4-triazol-3-yl]pyridine IUPAC Name: 3-[5-[(5-bromo-2-methoxyphenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]pyridine Traditional Name: 3-[5-[(5-bromo-2-methoxy-benzyl)thio]-4-methyl-1,2,4-triazol-3-yl]pyridine Formula: C16H15BrN4OS MolecularWeight: 391.2855

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=C(C=CC(=C2)Br)OC)C3=CN=CC=C3

Isomeric SMILES

CN1C(=NN=C1SCC2=C(C=CC(=C2)Br)OC)C3=CN=CC=C3

InChI

InChI=1S/C16H15BrN4OS/c1-21-15(11-4-3-7-18-9-11)19-20-16(21)23-10-12-8-13(17)5-6-14(12)22-2/h3-9H,10H2,1-2H3