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

Systemtic Name: 3-[(2,4-dichlorophenyl)methylsulfanyl]-5-(2-methoxyphenyl)-4-phenyl-1,2,4-triazole Openeye Name: 3-[(2,4-dichlorophenyl)methylsulfanyl]-5-(2-methoxyphenyl)-4-phenyl-1,2,4-triazole CAS Name: 3-[(2,4-dichlorophenyl)methylthio]-5-(2-methoxyphenyl)-4-phenyl-1,2,4-triazole IUPAC Name: 3-[(2,4-dichlorophenyl)methylsulfanyl]-5-(2-methoxyphenyl)-4-phenyl-1,2,4-triazole Traditional Name: 3-[(2,4-dichlorobenzyl)thio]-5-(2-methoxyphenyl)-4-phenyl-1,2,4-triazole Formula: C22H17Cl2N3OS MolecularWeight: 442.36088

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NN=C(N2C3=CC=CC=C3)SCC4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

COC1=CC=CC=C1C2=NN=C(N2C3=CC=CC=C3)SCC4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C22H17Cl2N3OS/c1-28-20-10-6-5-9-18(20)21-25-26-22(27(21)17-7-3-2-4-8-17)29-14-15-11-12-16(23)13-19(15)24/h2-13H,14H2,1H3