3-cyclohexyl-5-[2-(2,5-dimethylphenoxy)ethylsulfanyl]-4-phenyl-1,2,4-triazole

Systemtic Name: 3-cyclohexyl-5-[2-(2,5-dimethylphenoxy)ethylsulfanyl]-4-phenyl-1,2,4-triazole Openeye Name: 3-cyclohexyl-5-[2-(2,5-dimethylphenoxy)ethylsulfanyl]-4-phenyl-1,2,4-triazole CAS Name: 3-cyclohexyl-5-[2-(2,5-dimethylphenoxy)ethylthio]-4-phenyl-1,2,4-triazole IUPAC Name: 3-cyclohexyl-5-[2-(2,5-dimethylphenoxy)ethylsulfanyl]-4-phenyl-1,2,4-triazole Traditional Name: 3-cyclohexyl-5-[2-(2,5-dimethylphenoxy)ethylthio]-4-phenyl-1,2,4-triazole Formula: C24H29N3OS MolecularWeight: 407.57156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCCSC2=NN=C(N2C3=CC=CC=C3)C4CCCCC4

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCCSC2=NN=C(N2C3=CC=CC=C3)C4CCCCC4

InChI

InChI=1S/C24H29N3OS/c1-18-13-14-19(2)22(17-18)28-15-16-29-24-26-25-23(20-9-5-3-6-10-20)27(24)21-11-7-4-8-12-21/h4,7-8,11-14,17,20H,3,5-6,9-10,15-16H2,1-2H3