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

Systemtic Name: 3-[(4-bromophenyl)methylsulfanyl]-5-(2-chlorophenyl)-4-ethyl-1,2,4-triazole Openeye Name: 3-[(4-bromophenyl)methylsulfanyl]-5-(2-chlorophenyl)-4-ethyl-1,2,4-triazole CAS Name: 3-[(4-bromophenyl)methylthio]-5-(2-chlorophenyl)-4-ethyl-1,2,4-triazole IUPAC Name: 3-[(4-bromophenyl)methylsulfanyl]-5-(2-chlorophenyl)-4-ethyl-1,2,4-triazole Traditional Name: 3-[(4-bromobenzyl)thio]-5-(2-chlorophenyl)-4-ethyl-1,2,4-triazole Formula: C17H15BrClN3S MolecularWeight: 408.7431

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC=C(C=C2)Br)C3=CC=CC=C3Cl

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC=C(C=C2)Br)C3=CC=CC=C3Cl

InChI

InChI=1S/C17H15BrClN3S/c1-2-22-16(14-5-3-4-6-15(14)19)20-21-17(22)23-11-12-7-9-13(18)10-8-12/h3-10H,2,11H2,1H3