2-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-ethanamide

Systemtic Name: 2-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-ethanamide Openeye Name: 2-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-acetamide CAS Name: 2-[(1-butyl-4,5-dimethyl-2-imidazolyl)thio]-N-(5-spiro[1,3-benzodioxole-2,1'-cyclopentane]yl)acetamide IUPAC Name: 2-(1-butyl-4,5-dimethylimidazol-2-yl)sulfanyl-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylacetamide Traditional Name: 2-[(1-butyl-4,5-dimethyl-imidazol-2-yl)thio]-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-acetamide Formula: C22H29N3O3S MolecularWeight: 415.54896

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(N=C1SCC(=O)NC2=CC3=C(C=C2)OC4(O3)CCCC4)C)C

Isomeric SMILES

CCCCN1C(=C(N=C1SCC(=O)NC2=CC3=C(C=C2)OC4(O3)CCCC4)C)C

InChI

InChI=1S/C22H29N3O3S/c1-4-5-12-25-16(3)15(2)23-21(25)29-14-20(26)24-17-8-9-18-19(13-17)28-22(27-18)10-6-7-11-22/h8-9,13H,4-7,10-12,14H2,1-3H3,(H,24,26)