4-[[5-(4-bromophenyl)-4-cyclohexyl-1,2,4-triazol-3-yl]sulfanylmethyl]-3,5-dimethyl-1,2-oxazole

Systemtic Name: 4-[[5-(4-bromophenyl)-4-cyclohexyl-1,2,4-triazol-3-yl]sulfanylmethyl]-3,5-dimethyl-1,2-oxazole Openeye Name: 4-[[5-(4-bromophenyl)-4-cyclohexyl-1,2,4-triazol-3-yl]sulfanylmethyl]-3,5-dimethyl-isoxazole CAS Name: 4-[[[5-(4-bromophenyl)-4-cyclohexyl-1,2,4-triazol-3-yl]thio]methyl]-3,5-dimethylisoxazole IUPAC Name: 4-[[5-(4-bromophenyl)-4-cyclohexyl-1,2,4-triazol-3-yl]sulfanylmethyl]-3,5-dimethyl-1,2-oxazole Traditional Name: 4-[[[5-(4-bromophenyl)-4-cyclohexyl-1,2,4-triazol-3-yl]thio]methyl]-3,5-dimethyl-isoxazole Formula: C20H23BrN4OS MolecularWeight: 447.39182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSC2=NN=C(N2C3CCCCC3)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=C(C(=NO1)C)CSC2=NN=C(N2C3CCCCC3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C20H23BrN4OS/c1-13-18(14(2)26-24-13)12-27-20-23-22-19(15-8-10-16(21)11-9-15)25(20)17-6-4-3-5-7-17/h8-11,17H,3-7,12H2,1-2H3