5-(2-cyclopentylethyl)-3-[(3-methoxyphenyl)methylsulfanyl]-1H-1,2,4-triazole

Systemtic Name: 5-(2-cyclopentylethyl)-3-[(3-methoxyphenyl)methylsulfanyl]-1H-1,2,4-triazole Openeye Name: 5-(2-cyclopentylethyl)-3-[(3-methoxyphenyl)methylsulfanyl]-1H-1,2,4-triazole CAS Name: 5-(2-cyclopentylethyl)-3-[(3-methoxyphenyl)methylthio]-1H-1,2,4-triazole IUPAC Name: 5-(2-cyclopentylethyl)-3-[(3-methoxyphenyl)methylsulfanyl]-1H-1,2,4-triazole Traditional Name: 5-(2-cyclopentylethyl)-3-(m-anisylthio)-1H-1,2,4-triazole Formula: C17H23N3OS MolecularWeight: 317.44902

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CSC2=NNC(=N2)CCC3CCCC3

Isomeric SMILES

COC1=CC=CC(=C1)CSC2=NNC(=N2)CCC3CCCC3

InChI

InChI=1S/C17H23N3OS/c1-21-15-8-4-7-14(11-15)12-22-17-18-16(19-20-17)10-9-13-5-2-3-6-13/h4,7-8,11,13H,2-3,5-6,9-10,12H2,1H3,(H,18,19,20)