3-[(4-bromophenyl)methylsulfanyl]-4-cyclohexyl-5-(2,4-dichlorophenyl)-1,2,4-triazole

Systemtic Name: 3-[(4-bromophenyl)methylsulfanyl]-4-cyclohexyl-5-(2,4-dichlorophenyl)-1,2,4-triazole Openeye Name: 3-[(4-bromophenyl)methylsulfanyl]-4-cyclohexyl-5-(2,4-dichlorophenyl)-1,2,4-triazole CAS Name: 3-[(4-bromophenyl)methylthio]-4-cyclohexyl-5-(2,4-dichlorophenyl)-1,2,4-triazole IUPAC Name: 3-[(4-bromophenyl)methylsulfanyl]-4-cyclohexyl-5-(2,4-dichlorophenyl)-1,2,4-triazole Traditional Name: 3-[(4-bromobenzyl)thio]-4-cyclohexyl-5-(2,4-dichlorophenyl)-1,2,4-triazole Formula: C21H20BrCl2N3S MolecularWeight: 497.2786

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=NN=C2SCC3=CC=C(C=C3)Br)C4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

C1CCC(CC1)N2C(=NN=C2SCC3=CC=C(C=C3)Br)C4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C21H20BrCl2N3S/c22-15-8-6-14(7-9-15)13-28-21-26-25-20(18-11-10-16(23)12-19(18)24)27(21)17-4-2-1-3-5-17/h6-12,17H,1-5,13H2