3-[2-(4-tert-butylphenoxy)ethylsulfanyl]-4-phenyl-5-(phenylsulfanylmethyl)-1,2,4-triazole

Systemtic Name: 3-[2-(4-tert-butylphenoxy)ethylsulfanyl]-4-phenyl-5-(phenylsulfanylmethyl)-1,2,4-triazole Openeye Name: 3-[2-(4-tert-butylphenoxy)ethylsulfanyl]-4-phenyl-5-(phenylsulfanylmethyl)-1,2,4-triazole CAS Name: 3-[2-(4-tert-butylphenoxy)ethylthio]-4-phenyl-5-[(phenylthio)methyl]-1,2,4-triazole IUPAC Name: 3-[2-(4-tert-butylphenoxy)ethylsulfanyl]-4-phenyl-5-(phenylsulfanylmethyl)-1,2,4-triazole Traditional Name: 3-[2-(4-tert-butylphenoxy)ethylthio]-4-phenyl-5-[(phenylthio)methyl]-1,2,4-triazole Formula: C27H29N3OS2 MolecularWeight: 475.66866

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCCSC2=NN=C(N2C3=CC=CC=C3)CSC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCCSC2=NN=C(N2C3=CC=CC=C3)CSC4=CC=CC=C4

InChI

InChI=1S/C27H29N3OS2/c1-27(2,3)21-14-16-23(17-15-21)31-18-19-32-26-29-28-25(20-33-24-12-8-5-9-13-24)30(26)22-10-6-4-7-11-22/h4-17H,18-20H2,1-3H3