3-(4-bromophenyl)-4-cyclohexyl-5-[2-(4-methoxyphenoxy)ethylsulfanyl]-1,2,4-triazole

Systemtic Name: 3-(4-bromophenyl)-4-cyclohexyl-5-[2-(4-methoxyphenoxy)ethylsulfanyl]-1,2,4-triazole Openeye Name: 3-(4-bromophenyl)-4-cyclohexyl-5-[2-(4-methoxyphenoxy)ethylsulfanyl]-1,2,4-triazole CAS Name: 3-(4-bromophenyl)-4-cyclohexyl-5-[2-(4-methoxyphenoxy)ethylthio]-1,2,4-triazole IUPAC Name: 3-(4-bromophenyl)-4-cyclohexyl-5-[2-(4-methoxyphenoxy)ethylsulfanyl]-1,2,4-triazole Traditional Name: 3-(4-bromophenyl)-4-cyclohexyl-5-[2-(4-methoxyphenoxy)ethylthio]-1,2,4-triazole Formula: C23H26BrN3O2S MolecularWeight: 488.44044

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCCSC2=NN=C(N2C3CCCCC3)C4=CC=C(C=C4)Br

Isomeric SMILES

COC1=CC=C(C=C1)OCCSC2=NN=C(N2C3CCCCC3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C23H26BrN3O2S/c1-28-20-11-13-21(14-12-20)29-15-16-30-23-26-25-22(17-7-9-18(24)10-8-17)27(23)19-5-3-2-4-6-19/h7-14,19H,2-6,15-16H2,1H3