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

Systemtic Name: 3-[(4-bromophenyl)methylsulfanyl]-5-ethyl-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-[(4-bromophenyl)methylsulfanyl]-5-ethyl-1,2,4-triazole CAS Name: 3-[(4-bromophenyl)methylthio]-5-ethyl-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-[(4-bromophenyl)methylsulfanyl]-5-ethyl-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-[(4-bromobenzyl)thio]-5-ethyl-1,2,4-triazole Formula: C14H16BrN3S MolecularWeight: 338.26594

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(N1CC=C)SCC2=CC=C(C=C2)Br

Isomeric SMILES

CCC1=NN=C(N1CC=C)SCC2=CC=C(C=C2)Br

InChI

InChI=1S/C14H16BrN3S/c1-3-9-18-13(4-2)16-17-14(18)19-10-11-5-7-12(15)8-6-11/h3,5-8H,1,4,9-10H2,2H3