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

Systemtic Name: 3-[2-(3-bromanylphenoxy)ethylsulfanyl]-4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazole Openeye Name: 3-[2-(3-bromophenoxy)ethylsulfanyl]-4-cyclopropyl-5-(2-thienylmethyl)-1,2,4-triazole CAS Name: 3-[2-(3-bromophenoxy)ethylthio]-4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazole IUPAC Name: 3-[2-(3-bromophenoxy)ethylsulfanyl]-4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazole Traditional Name: 3-[2-(3-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(=CC=C3)Br)CC4=CC=CS4

Isomeric SMILES

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

InChI

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