3-[(4-bromophenyl)methylsulfanyl]-4-ethyl-5-phenethyl-1,2,4-triazole

Systemtic Name: 3-[(4-bromophenyl)methylsulfanyl]-4-ethyl-5-phenethyl-1,2,4-triazole Openeye Name: 3-[(4-bromophenyl)methylsulfanyl]-4-ethyl-5-phenethyl-1,2,4-triazole CAS Name: 3-[(4-bromophenyl)methylthio]-4-ethyl-5-phenethyl-1,2,4-triazole IUPAC Name: 3-[(4-bromophenyl)methylsulfanyl]-4-ethyl-5-phenethyl-1,2,4-triazole Traditional Name: 3-[(4-bromobenzyl)thio]-4-ethyl-5-phenethyl-1,2,4-triazole Formula: C19H20BrN3S MolecularWeight: 402.3512

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC=C(C=C2)Br)CCC3=CC=CC=C3

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC=C(C=C2)Br)CCC3=CC=CC=C3

InChI

InChI=1S/C19H20BrN3S/c1-2-23-18(13-10-15-6-4-3-5-7-15)21-22-19(23)24-14-16-8-11-17(20)12-9-16/h3-9,11-12H,2,10,13-14H2,1H3