5-(5-chloranyl-2-methoxy-phenyl)-3-[2-(3-methylphenoxy)ethylsulfanyl]-1H-1,2,4-triazole

Systemtic Name: 5-(5-chloranyl-2-methoxy-phenyl)-3-[2-(3-methylphenoxy)ethylsulfanyl]-1H-1,2,4-triazole Openeye Name: 5-(5-chloro-2-methoxy-phenyl)-3-[2-(3-methylphenoxy)ethylsulfanyl]-1H-1,2,4-triazole CAS Name: 5-(5-chloro-2-methoxyphenyl)-3-[2-(3-methylphenoxy)ethylthio]-1H-1,2,4-triazole IUPAC Name: 5-(5-chloro-2-methoxyphenyl)-3-[2-(3-methylphenoxy)ethylsulfanyl]-1H-1,2,4-triazole Traditional Name: 5-(5-chloro-2-methoxy-phenyl)-3-[2-(3-methylphenoxy)ethylthio]-1H-1,2,4-triazole Formula: C18H18ClN3O2S MolecularWeight: 375.87242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCSC2=NNC(=N2)C3=C(C=CC(=C3)Cl)OC

Isomeric SMILES

CC1=CC(=CC=C1)OCCSC2=NNC(=N2)C3=C(C=CC(=C3)Cl)OC

InChI

InChI=1S/C18H18ClN3O2S/c1-12-4-3-5-14(10-12)24-8-9-25-18-20-17(21-22-18)15-11-13(19)6-7-16(15)23-2/h3-7,10-11H,8-9H2,1-2H3,(H,20,21,22)