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

Systemtic Name: 3-[(5-chloranyl-2-methoxy-phenyl)methylsulfanyl]-5-cyclopropyl-4-phenyl-1,2,4-triazole Openeye Name: 3-[(5-chloro-2-methoxy-phenyl)methylsulfanyl]-5-cyclopropyl-4-phenyl-1,2,4-triazole CAS Name: 3-[(5-chloro-2-methoxyphenyl)methylthio]-5-cyclopropyl-4-phenyl-1,2,4-triazole IUPAC Name: 3-[(5-chloro-2-methoxyphenyl)methylsulfanyl]-5-cyclopropyl-4-phenyl-1,2,4-triazole Traditional Name: 3-[(5-chloro-2-methoxy-benzyl)thio]-5-cyclopropyl-4-phenyl-1,2,4-triazole Formula: C19H18ClN3OS MolecularWeight: 371.88372

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)CSC2=NN=C(N2C3=CC=CC=C3)C4CC4

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)CSC2=NN=C(N2C3=CC=CC=C3)C4CC4

InChI

InChI=1S/C19H18ClN3OS/c1-24-17-10-9-15(20)11-14(17)12-25-19-22-21-18(13-7-8-13)23(19)16-5-3-2-4-6-16/h2-6,9-11,13H,7-8,12H2,1H3