2-[2-(dimethylamino)-2-oxidanylidene-ethyl]sulfanyl-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-benzamide

Systemtic Name: 2-[2-(dimethylamino)-2-oxidanylidene-ethyl]sulfanyl-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-benzamide Openeye Name: 2-[2-(dimethylamino)-2-oxo-ethyl]sulfanyl-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-benzamide CAS Name: 2-[[2-(dimethylamino)-2-oxoethyl]thio]-N-(5-spiro[1,3-benzodioxole-2,1'-cyclohexane]yl)benzamide IUPAC Name: 2-[2-(dimethylamino)-2-oxoethyl]sulfanyl-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-ylbenzamide Traditional Name: 2-[[2-(dimethylamino)-2-keto-ethyl]thio]-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-benzamide Formula: C23H26N2O4S MolecularWeight: 426.52854

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CSC1=CC=CC=C1C(=O)NC2=CC3=C(C=C2)OC4(O3)CCCCC4

Isomeric SMILES

CN(C)C(=O)CSC1=CC=CC=C1C(=O)NC2=CC3=C(C=C2)OC4(O3)CCCCC4

InChI

InChI=1S/C23H26N2O4S/c1-25(2)21(26)15-30-20-9-5-4-8-17(20)22(27)24-16-10-11-18-19(14-16)29-23(28-18)12-6-3-7-13-23/h4-5,8-11,14H,3,6-7,12-13,15H2,1-2H3,(H,24,27)