3-[2-(4-chloranylphenoxy)ethylsulfanyl]-4-cyclohexyl-5-(naphthalen-1-ylmethyl)-1,2,4-triazole

Systemtic Name: 3-[2-(4-chloranylphenoxy)ethylsulfanyl]-4-cyclohexyl-5-(naphthalen-1-ylmethyl)-1,2,4-triazole Openeye Name: 3-[2-(4-chlorophenoxy)ethylsulfanyl]-4-cyclohexyl-5-(1-naphthylmethyl)-1,2,4-triazole CAS Name: 3-[2-(4-chlorophenoxy)ethylthio]-4-cyclohexyl-5-(1-naphthalenylmethyl)-1,2,4-triazole IUPAC Name: 3-[2-(4-chlorophenoxy)ethylsulfanyl]-4-cyclohexyl-5-(naphthalen-1-ylmethyl)-1,2,4-triazole Traditional Name: 3-[2-(4-chlorophenoxy)ethylthio]-4-cyclohexyl-5-(1-naphthylmethyl)-1,2,4-triazole Formula: C27H28ClN3OS MolecularWeight: 478.04872

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=NN=C2SCCOC3=CC=C(C=C3)Cl)CC4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1CCC(CC1)N2C(=NN=C2SCCOC3=CC=C(C=C3)Cl)CC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C27H28ClN3OS/c28-22-13-15-24(16-14-22)32-17-18-33-27-30-29-26(31(27)23-10-2-1-3-11-23)19-21-9-6-8-20-7-4-5-12-25(20)21/h4-9,12-16,23H,1-3,10-11,17-19H2