3-[2-(4-bromanylphenoxy)ethylsulfanyl]-4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazole

Systemtic Name: 3-[2-(4-bromanylphenoxy)ethylsulfanyl]-4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazole Openeye Name: 3-[2-(4-bromophenoxy)ethylsulfanyl]-4-cyclopropyl-5-(2-thienylmethyl)-1,2,4-triazole CAS Name: 3-[2-(4-bromophenoxy)ethylthio]-4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazole IUPAC Name: 3-[2-(4-bromophenoxy)ethylsulfanyl]-4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazole Traditional Name: 3-[2-(4-bromophenoxy)ethylthio]-4-cyclopropyl-5-(2-thenyl)-1,2,4-triazole Formula: C18H18BrN3OS2 MolecularWeight: 436.38902

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SCCOC3=CC=C(C=C3)Br)CC4=CC=CS4

Isomeric SMILES

C1CC1N2C(=NN=C2SCCOC3=CC=C(C=C3)Br)CC4=CC=CS4

InChI

InChI=1S/C18H18BrN3OS2/c19-13-3-7-15(8-4-13)23-9-11-25-18-21-20-17(22(18)14-5-6-14)12-16-2-1-10-24-16/h1-4,7-8,10,14H,5-6,9,11-12H2