5,5,8,8-tetramethyl-2-[(5-methylpyridin-2-yl)methylsulfanyl]-6,7-dihydro-1H-benzo[f]benzimidazole

Systemtic Name: 5,5,8,8-tetramethyl-2-[(5-methylpyridin-2-yl)methylsulfanyl]-6,7-dihydro-1H-benzo[f]benzimidazole Openeye Name: 5,5,8,8-tetramethyl-2-[(5-methyl-2-pyridyl)methylsulfanyl]-6,7-dihydro-1H-benzo[f]benzimidazole CAS Name: 5,5,8,8-tetramethyl-2-[(5-methyl-2-pyridinyl)methylthio]-6,7-dihydro-1H-benzo[f]benzimidazole IUPAC Name: 5,5,8,8-tetramethyl-2-[(5-methylpyridin-2-yl)methylsulfanyl]-6,7-dihydro-1H-benzo[f]benzimidazole Traditional Name: 5,5,8,8-tetramethyl-2-[(5-methyl-2-pyridyl)methylthio]-6,7-dihydro-1H-benzo[f]benzimidazole Formula: C22H27N3S MolecularWeight: 365.53488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)CSC2=NC3=C(N2)C=C4C(=C3)C(CCC4(C)C)(C)C

Isomeric SMILES

CC1=CN=C(C=C1)CSC2=NC3=C(N2)C=C4C(=C3)C(CCC4(C)C)(C)C

InChI

InChI=1S/C22H27N3S/c1-14-6-7-15(23-12-14)13-26-20-24-18-10-16-17(11-19(18)25-20)22(4,5)9-8-21(16,2)3/h6-7,10-12H,8-9,13H2,1-5H3,(H,24,25)