3-[(3-chlorophenyl)methylsulfanyl]-5-(2-cyclohexylethyl)-4-ethyl-1,2,4-triazole

Systemtic Name: 3-[(3-chlorophenyl)methylsulfanyl]-5-(2-cyclohexylethyl)-4-ethyl-1,2,4-triazole Openeye Name: 3-[(3-chlorophenyl)methylsulfanyl]-5-(2-cyclohexylethyl)-4-ethyl-1,2,4-triazole CAS Name: 3-[(3-chlorophenyl)methylthio]-5-(2-cyclohexylethyl)-4-ethyl-1,2,4-triazole IUPAC Name: 3-[(3-chlorophenyl)methylsulfanyl]-5-(2-cyclohexylethyl)-4-ethyl-1,2,4-triazole Traditional Name: 3-[(3-chlorobenzyl)thio]-5-(2-cyclohexylethyl)-4-ethyl-1,2,4-triazole Formula: C19H26ClN3S MolecularWeight: 363.94784

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC(=CC=C2)Cl)CCC3CCCCC3

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC(=CC=C2)Cl)CCC3CCCCC3

InChI

InChI=1S/C19H26ClN3S/c1-2-23-18(12-11-15-7-4-3-5-8-15)21-22-19(23)24-14-16-9-6-10-17(20)13-16/h6,9-10,13,15H,2-5,7-8,11-12,14H2,1H3