3-(4-cyclopentyloxyphenyl)-4-ethyl-5-[(3-methoxyphenyl)methylsulfanyl]-1,2,4-triazole

Systemtic Name: 3-(4-cyclopentyloxyphenyl)-4-ethyl-5-[(3-methoxyphenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 3-[4-(cyclopentoxy)phenyl]-4-ethyl-5-[(3-methoxyphenyl)methylsulfanyl]-1,2,4-triazole CAS Name: 3-(4-cyclopentyloxyphenyl)-4-ethyl-5-[(3-methoxyphenyl)methylthio]-1,2,4-triazole IUPAC Name: 3-(4-cyclopentyloxyphenyl)-4-ethyl-5-[(3-methoxyphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 3-[4-(cyclopentoxy)phenyl]-4-ethyl-5-(m-anisylthio)-1,2,4-triazole Formula: C23H27N3O2S MolecularWeight: 409.54438

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC(=CC=C2)OC)C3=CC=C(C=C3)OC4CCCC4

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC(=CC=C2)OC)C3=CC=C(C=C3)OC4CCCC4

InChI

InChI=1S/C23H27N3O2S/c1-3-26-22(18-11-13-20(14-12-18)28-19-8-4-5-9-19)24-25-23(26)29-16-17-7-6-10-21(15-17)27-2/h6-7,10-15,19H,3-5,8-9,16H2,1-2H3