4-[5-[(4-tert-butylphenyl)methylsulfanyl]-4-(4-ethylphenyl)-1,2,4-triazol-3-yl]pyridine

Systemtic Name: 4-[5-[(4-tert-butylphenyl)methylsulfanyl]-4-(4-ethylphenyl)-1,2,4-triazol-3-yl]pyridine Openeye Name: 4-[5-[(4-tert-butylphenyl)methylsulfanyl]-4-(4-ethylphenyl)-1,2,4-triazol-3-yl]pyridine CAS Name: 4-[5-[(4-tert-butylphenyl)methylthio]-4-(4-ethylphenyl)-1,2,4-triazol-3-yl]pyridine IUPAC Name: 4-[5-[(4-tert-butylphenyl)methylsulfanyl]-4-(4-ethylphenyl)-1,2,4-triazol-3-yl]pyridine Traditional Name: 4-[5-[(4-tert-butylbenzyl)thio]-4-(4-ethylphenyl)-1,2,4-triazol-3-yl]pyridine Formula: C26H28N4S MolecularWeight: 428.59232

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=C(C=C3)C(C)(C)C)C4=CC=NC=C4

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=C(C=C3)C(C)(C)C)C4=CC=NC=C4

InChI

InChI=1S/C26H28N4S/c1-5-19-8-12-23(13-9-19)30-24(21-14-16-27-17-15-21)28-29-25(30)31-18-20-6-10-22(11-7-20)26(2,3)4/h6-17H,5,18H2,1-4H3