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

Systemtic Name: 5-(2-cyclopentylethyl)-3-[(2-methylphenyl)methylsulfanyl]-1H-1,2,4-triazole Openeye Name: 5-(2-cyclopentylethyl)-3-(o-tolylmethylsulfanyl)-1H-1,2,4-triazole CAS Name: 5-(2-cyclopentylethyl)-3-[(2-methylphenyl)methylthio]-1H-1,2,4-triazole IUPAC Name: 5-(2-cyclopentylethyl)-3-[(2-methylphenyl)methylsulfanyl]-1H-1,2,4-triazole Traditional Name: 5-(2-cyclopentylethyl)-3-[(2-methylbenzyl)thio]-1H-1,2,4-triazole Formula: C17H23N3S MolecularWeight: 301.44962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NNC(=N2)CCC3CCCC3

Isomeric SMILES

CC1=CC=CC=C1CSC2=NNC(=N2)CCC3CCCC3

InChI

InChI=1S/C17H23N3S/c1-13-6-2-5-9-15(13)12-21-17-18-16(19-20-17)11-10-14-7-3-4-8-14/h2,5-6,9,14H,3-4,7-8,10-12H2,1H3,(H,18,19,20)