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

Systemtic Name: 3-[(5-bromanyl-2-methoxy-phenyl)methylsulfanyl]-4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazole Openeye Name: 3-[(5-bromo-2-methoxy-phenyl)methylsulfanyl]-4-cyclopropyl-5-(2-thienyl)-1,2,4-triazole CAS Name: 3-[(5-bromo-2-methoxyphenyl)methylthio]-4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazole IUPAC Name: 3-[(5-bromo-2-methoxyphenyl)methylsulfanyl]-4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazole Traditional Name: 3-[(5-bromo-2-methoxy-benzyl)thio]-4-cyclopropyl-5-(2-thienyl)-1,2,4-triazole Formula: C17H16BrN3OS2 MolecularWeight: 422.36244

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)CSC2=NN=C(N2C3CC3)C4=CC=CS4

Isomeric SMILES

COC1=C(C=C(C=C1)Br)CSC2=NN=C(N2C3CC3)C4=CC=CS4

InChI

InChI=1S/C17H16BrN3OS2/c1-22-14-7-4-12(18)9-11(14)10-24-17-20-19-16(15-3-2-8-23-15)21(17)13-5-6-13/h2-4,7-9,13H,5-6,10H2,1H3