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

Systemtic Name: 3-[(3-bromophenyl)methylsulfanyl]-5-(2-cyclopentylethyl)-1H-1,2,4-triazole Openeye Name: 3-[(3-bromophenyl)methylsulfanyl]-5-(2-cyclopentylethyl)-1H-1,2,4-triazole CAS Name: 3-[(3-bromophenyl)methylthio]-5-(2-cyclopentylethyl)-1H-1,2,4-triazole IUPAC Name: 3-[(3-bromophenyl)methylsulfanyl]-5-(2-cyclopentylethyl)-1H-1,2,4-triazole Traditional Name: 3-[(3-bromobenzyl)thio]-5-(2-cyclopentylethyl)-1H-1,2,4-triazole Formula: C16H20BrN3S MolecularWeight: 366.3191

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CCC2=NC(=NN2)SCC3=CC(=CC=C3)Br

Isomeric SMILES

C1CCC(C1)CCC2=NC(=NN2)SCC3=CC(=CC=C3)Br

InChI

InChI=1S/C16H20BrN3S/c17-14-7-3-6-13(10-14)11-21-16-18-15(19-20-16)9-8-12-4-1-2-5-12/h3,6-7,10,12H,1-2,4-5,8-9,11H2,(H,18,19,20)