N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethanamide

Systemtic Name: N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethanamide Openeye Name: N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-2-[4-(2-thienylsulfonyl)piperazin-1-yl]acetamide CAS Name: N-(5-spiro[1,3-benzodioxole-2,1'-cyclohexane]yl)-2-(4-thiophen-2-ylsulfonyl-1-piperazinyl)acetamide IUPAC Name: N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)acetamide Traditional Name: N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-2-[4-(2-thienylsulfonyl)piperazino]acetamide Formula: C22H27N3O5S2 MolecularWeight: 477.59688

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)OC3=C(O2)C=C(C=C3)NC(=O)CN4CCN(CC4)S(=O)(=O)C5=CC=CS5

Isomeric SMILES

C1CCC2(CC1)OC3=C(O2)C=C(C=C3)NC(=O)CN4CCN(CC4)S(=O)(=O)C5=CC=CS5

InChI

InChI=1S/C22H27N3O5S2/c26-20(16-24-10-12-25(13-11-24)32(27,28)21-5-4-14-31-21)23-17-6-7-18-19(15-17)30-22(29-18)8-2-1-3-9-22/h4-7,14-15H,1-3,8-13,16H2,(H,23,26)