N-[(2-tert-butylsulfanyl-5-ethyl-6-methyl-pyridin-3-yl)methyl]-1,3-benzoxazol-2-amine

Systemtic Name: N-[(2-tert-butylsulfanyl-5-ethyl-6-methyl-pyridin-3-yl)methyl]-1,3-benzoxazol-2-amine Openeye Name: N-[(2-tert-butylsulfanyl-5-ethyl-6-methyl-3-pyridyl)methyl]-1,3-benzoxazol-2-amine CAS Name: N-[[2-(tert-butylthio)-5-ethyl-6-methyl-3-pyridinyl]methyl]-1,3-benzoxazol-2-amine IUPAC Name: N-[(2-tert-butylsulfanyl-5-ethyl-6-methylpyridin-3-yl)methyl]-1,3-benzoxazol-2-amine Traditional Name: 1,3-benzoxazol-2-yl-[[2-(tert-butylthio)-5-ethyl-6-methyl-3-pyridyl]methyl]amine Formula: C20H25N3OS MolecularWeight: 355.497

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(N=C1C)SC(C)(C)C)CNC2=NC3=CC=CC=C3O2

Isomeric SMILES

CCC1=CC(=C(N=C1C)SC(C)(C)C)CNC2=NC3=CC=CC=C3O2

InChI

InChI=1S/C20H25N3OS/c1-6-14-11-15(18(22-13(14)2)25-20(3,4)5)12-21-19-23-16-9-7-8-10-17(16)24-19/h7-11H,6,12H2,1-5H3,(H,21,23)