2-(3H-benzimidazol-5-yl)-N-[(6-tert-butyl-2-cyclohexylsulfanyl-pyridin-3-yl)methyl]propanamide

Systemtic Name: 2-(3H-benzimidazol-5-yl)-N-[(6-tert-butyl-2-cyclohexylsulfanyl-pyridin-3-yl)methyl]propanamide Openeye Name: 2-(3H-benzimidazol-5-yl)-N-[(6-tert-butyl-2-cyclohexylsulfanyl-3-pyridyl)methyl]propanamide CAS Name: 2-(3H-benzimidazol-5-yl)-N-[[6-tert-butyl-2-(cyclohexylthio)-3-pyridinyl]methyl]propanamide IUPAC Name: 2-(3H-benzimidazol-5-yl)-N-[(6-tert-butyl-2-cyclohexylsulfanylpyridin-3-yl)methyl]propanamide Traditional Name: 2-(3H-benzimidazol-5-yl)-N-[[6-tert-butyl-2-(cyclohexylthio)-3-pyridyl]methyl]propionamide Formula: C26H34N4OS MolecularWeight: 450.63936

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)N=CN2)C(=O)NCC3=C(N=C(C=C3)C(C)(C)C)SC4CCCCC4

Isomeric SMILES

CC(C1=CC2=C(C=C1)N=CN2)C(=O)NCC3=C(N=C(C=C3)C(C)(C)C)SC4CCCCC4

InChI

InChI=1S/C26H34N4OS/c1-17(18-10-12-21-22(14-18)29-16-28-21)24(31)27-15-19-11-13-23(26(2,3)4)30-25(19)32-20-8-6-5-7-9-20/h10-14,16-17,20H,5-9,15H2,1-4H3,(H,27,31)(H,28,29)