3-(2-chloroethylsulfanyl)-4-cyclohexyl-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazole

Systemtic Name: 3-(2-chloroethylsulfanyl)-4-cyclohexyl-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazole Openeye Name: 3-(2-chloroethylsulfanyl)-4-cyclohexyl-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazole CAS Name: 3-(2-chloroethylthio)-4-cyclohexyl-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazole IUPAC Name: 3-(2-chloroethylsulfanyl)-4-cyclohexyl-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazole Traditional Name: 3-(2-chloroethylthio)-4-cyclohexyl-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazole Formula: C19H26ClN3O3S MolecularWeight: 411.94604

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=NN=C(N2C3CCCCC3)SCCCl

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=NN=C(N2C3CCCCC3)SCCCl

InChI

InChI=1S/C19H26ClN3O3S/c1-24-15-11-13(12-16(25-2)17(15)26-3)18-21-22-19(27-10-9-20)23(18)14-7-5-4-6-8-14/h11-12,14H,4-10H2,1-3H3