4-cyclohexyl-3-[(2,5-dimethylphenyl)methylsulfanyl]-5-(4-methoxyphenyl)-1,2,4-triazole

Systemtic Name: 4-cyclohexyl-3-[(2,5-dimethylphenyl)methylsulfanyl]-5-(4-methoxyphenyl)-1,2,4-triazole Openeye Name: 4-cyclohexyl-3-[(2,5-dimethylphenyl)methylsulfanyl]-5-(4-methoxyphenyl)-1,2,4-triazole CAS Name: 4-cyclohexyl-3-[(2,5-dimethylphenyl)methylthio]-5-(4-methoxyphenyl)-1,2,4-triazole IUPAC Name: 4-cyclohexyl-3-[(2,5-dimethylphenyl)methylsulfanyl]-5-(4-methoxyphenyl)-1,2,4-triazole Traditional Name: 4-cyclohexyl-3-[(2,5-dimethylbenzyl)thio]-5-(4-methoxyphenyl)-1,2,4-triazole Formula: C24H29N3OS MolecularWeight: 407.57156

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CSC2=NN=C(N2C3CCCCC3)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)CSC2=NN=C(N2C3CCCCC3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C24H29N3OS/c1-17-9-10-18(2)20(15-17)16-29-24-26-25-23(19-11-13-22(28-3)14-12-19)27(24)21-7-5-4-6-8-21/h9-15,21H,4-8,16H2,1-3H3