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

Systemtic Name: 3-[(3-bromanyl-4-methoxy-phenyl)methylsulfanyl]-4-methyl-5-(2-methylfuran-3-yl)-1,2,4-triazole Openeye Name: 3-[(3-bromo-4-methoxy-phenyl)methylsulfanyl]-4-methyl-5-(2-methyl-3-furyl)-1,2,4-triazole CAS Name: 3-[(3-bromo-4-methoxyphenyl)methylthio]-4-methyl-5-(2-methyl-3-furanyl)-1,2,4-triazole IUPAC Name: 3-[(3-bromo-4-methoxyphenyl)methylsulfanyl]-4-methyl-5-(2-methylfuran-3-yl)-1,2,4-triazole Traditional Name: 3-[(3-bromo-4-methoxy-benzyl)thio]-4-methyl-5-(2-methyl-3-furyl)-1,2,4-triazole Formula: C16H16BrN3O2S MolecularWeight: 394.28614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C2=NN=C(N2C)SCC3=CC(=C(C=C3)OC)Br

Isomeric SMILES

CC1=C(C=CO1)C2=NN=C(N2C)SCC3=CC(=C(C=C3)OC)Br

InChI

InChI=1S/C16H16BrN3O2S/c1-10-12(6-7-22-10)15-18-19-16(20(15)2)23-9-11-4-5-14(21-3)13(17)8-11/h4-8H,9H2,1-3H3