3-[2-[(4-methoxy-3-methyl-phenyl)methylsulfanyl]ethyl]-4-phenyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[2-[(4-methoxy-3-methyl-phenyl)methylsulfanyl]ethyl]-4-phenyl-1H-1,2,4-triazole-5-thione Openeye Name: 3-[2-[(4-methoxy-3-methyl-phenyl)methylsulfanyl]ethyl]-4-phenyl-1H-1,2,4-triazole-5-thione CAS Name: 3-[2-[(4-methoxy-3-methylphenyl)methylthio]ethyl]-4-phenyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[2-[(4-methoxy-3-methylphenyl)methylsulfanyl]ethyl]-4-phenyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-[2-[(4-methoxy-3-methyl-benzyl)thio]ethyl]-4-phenyl-1H-1,2,4-triazole-5-thione Formula: C19H21N3OS2 MolecularWeight: 371.51954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CSCCC2=NNC(=S)N2C3=CC=CC=C3)OC

Isomeric SMILES

CC1=C(C=CC(=C1)CSCCC2=NNC(=S)N2C3=CC=CC=C3)OC

InChI

InChI=1S/C19H21N3OS2/c1-14-12-15(8-9-17(14)23-2)13-25-11-10-18-20-21-19(24)22(18)16-6-4-3-5-7-16/h3-9,12H,10-11,13H2,1-2H3,(H,21,24)