2-[2-(methylsulfanylmethyl)benzimidazol-1-yl]-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-ethanamide

Systemtic Name: 2-[2-(methylsulfanylmethyl)benzimidazol-1-yl]-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-ethanamide Openeye Name: 2-[2-(methylsulfanylmethyl)benzimidazol-1-yl]-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-acetamide CAS Name: 2-[2-[(methylthio)methyl]-1-benzimidazolyl]-N-(5-spiro[1,3-benzodioxole-2,1'-cyclopentane]yl)acetamide IUPAC Name: 2-[2-(methylsulfanylmethyl)benzimidazol-1-yl]-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylacetamide Traditional Name: 2-[2-[(methylthio)methyl]benzimidazol-1-yl]-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-acetamide Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

CSCC1=NC2=CC=CC=C2N1CC(=O)NC3=CC4=C(C=C3)OC5(O4)CCCC5

Isomeric SMILES

CSCC1=NC2=CC=CC=C2N1CC(=O)NC3=CC4=C(C=C3)OC5(O4)CCCC5

InChI

InChI=1S/C22H23N3O3S/c1-29-14-20-24-16-6-2-3-7-17(16)25(20)13-21(26)23-15-8-9-18-19(12-15)28-22(27-18)10-4-5-11-22/h2-3,6-9,12H,4-5,10-11,13-14H2,1H3,(H,23,26)