3-[(2,4-dichlorophenyl)methylsulfanyl]-5-(2-methoxyphenyl)-4-phenethyl-1,2,4-triazole

Systemtic Name: 3-[(2,4-dichlorophenyl)methylsulfanyl]-5-(2-methoxyphenyl)-4-phenethyl-1,2,4-triazole Openeye Name: 3-[(2,4-dichlorophenyl)methylsulfanyl]-5-(2-methoxyphenyl)-4-phenethyl-1,2,4-triazole CAS Name: 3-[(2,4-dichlorophenyl)methylthio]-5-(2-methoxyphenyl)-4-phenethyl-1,2,4-triazole IUPAC Name: 3-[(2,4-dichlorophenyl)methylsulfanyl]-5-(2-methoxyphenyl)-4-phenethyl-1,2,4-triazole Traditional Name: 3-[(2,4-dichlorobenzyl)thio]-5-(2-methoxyphenyl)-4-phenethyl-1,2,4-triazole Formula: C24H21Cl2N3OS MolecularWeight: 470.41404

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NN=C(N2CCC3=CC=CC=C3)SCC4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

COC1=CC=CC=C1C2=NN=C(N2CCC3=CC=CC=C3)SCC4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C24H21Cl2N3OS/c1-30-22-10-6-5-9-20(22)23-27-28-24(29(23)14-13-17-7-3-2-4-8-17)31-16-18-11-12-19(25)15-21(18)26/h2-12,15H,13-14,16H2,1H3