3-[(4-tert-butylphenyl)methylsulfanyl]-5-phenyl-1H-1,2,4-triazole

Systemtic Name: 3-[(4-tert-butylphenyl)methylsulfanyl]-5-phenyl-1H-1,2,4-triazole Openeye Name: 3-[(4-tert-butylphenyl)methylsulfanyl]-5-phenyl-1H-1,2,4-triazole CAS Name: 3-[(4-tert-butylphenyl)methylthio]-5-phenyl-1H-1,2,4-triazole IUPAC Name: 3-[(4-tert-butylphenyl)methylsulfanyl]-5-phenyl-1H-1,2,4-triazole Traditional Name: 3-[(4-tert-butylbenzyl)thio]-5-phenyl-1H-1,2,4-triazole Formula: C19H21N3S MolecularWeight: 323.45514

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CSC2=NNC(=N2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CSC2=NNC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C19H21N3S/c1-19(2,3)16-11-9-14(10-12-16)13-23-18-20-17(21-22-18)15-7-5-4-6-8-15/h4-12H,13H2,1-3H3,(H,20,21,22)