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

Systemtic Name: 5-(5-chloranyl-2-methoxy-phenyl)-3-[(3-methoxyphenyl)methylsulfanyl]-1H-1,2,4-triazole Openeye Name: 5-(5-chloro-2-methoxy-phenyl)-3-[(3-methoxyphenyl)methylsulfanyl]-1H-1,2,4-triazole CAS Name: 5-(5-chloro-2-methoxyphenyl)-3-[(3-methoxyphenyl)methylthio]-1H-1,2,4-triazole IUPAC Name: 5-(5-chloro-2-methoxyphenyl)-3-[(3-methoxyphenyl)methylsulfanyl]-1H-1,2,4-triazole Traditional Name: 5-(5-chloro-2-methoxy-phenyl)-3-(m-anisylthio)-1H-1,2,4-triazole Formula: C17H16ClN3O2S MolecularWeight: 361.84584

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C2=NC(=NN2)SCC3=CC(=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C2=NC(=NN2)SCC3=CC(=CC=C3)OC

InChI

InChI=1S/C17H16ClN3O2S/c1-22-13-5-3-4-11(8-13)10-24-17-19-16(20-21-17)14-9-12(18)6-7-15(14)23-2/h3-9H,10H2,1-2H3,(H,19,20,21)