3-[(3-bromophenyl)methylsulfanyl]-4,5-di(propan-2-yl)-1,2,4-triazole

Systemtic Name: 3-[(3-bromophenyl)methylsulfanyl]-4,5-di(propan-2-yl)-1,2,4-triazole Openeye Name: 3-[(3-bromophenyl)methylsulfanyl]-4,5-diisopropyl-1,2,4-triazole CAS Name: 3-[(3-bromophenyl)methylthio]-4,5-di(propan-2-yl)-1,2,4-triazole IUPAC Name: 3-[(3-bromophenyl)methylsulfanyl]-4,5-di(propan-2-yl)-1,2,4-triazole Traditional Name: 3-[(3-bromobenzyl)thio]-4,5-diisopropyl-1,2,4-triazole Formula: C15H20BrN3S MolecularWeight: 354.3084

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(N1C(C)C)SCC2=CC(=CC=C2)Br

Isomeric SMILES

CC(C)C1=NN=C(N1C(C)C)SCC2=CC(=CC=C2)Br

InChI

InChI=1S/C15H20BrN3S/c1-10(2)14-17-18-15(19(14)11(3)4)20-9-12-6-5-7-13(16)8-12/h5-8,10-11H,9H2,1-4H3