1-[2-[(4-tert-butylpyridin-2-yl)methylsulfanyl]-3H-benzimidazol-5-yl]ethanone

Systemtic Name: 1-[2-[(4-tert-butylpyridin-2-yl)methylsulfanyl]-3H-benzimidazol-5-yl]ethanone Openeye Name: 1-[2-[(4-tert-butyl-2-pyridyl)methylsulfanyl]-3H-benzimidazol-5-yl]ethanone CAS Name: 1-[2-[(4-tert-butyl-2-pyridinyl)methylthio]-3H-benzimidazol-5-yl]ethanone IUPAC Name: 1-[2-[(4-tert-butylpyridin-2-yl)methylsulfanyl]-3H-benzimidazol-5-yl]ethanone Traditional Name: 1-[2-[(4-tert-butyl-2-pyridyl)methylthio]-3H-benzimidazol-5-yl]ethanone Formula: C19H21N3OS MolecularWeight: 339.45454

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)N=C(N2)SCC3=NC=CC(=C3)C(C)(C)C

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)N=C(N2)SCC3=NC=CC(=C3)C(C)(C)C

InChI

InChI=1S/C19H21N3OS/c1-12(23)13-5-6-16-17(9-13)22-18(21-16)24-11-15-10-14(7-8-20-15)19(2,3)4/h5-10H,11H2,1-4H3,(H,21,22)