2-[2-[2-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl]sulfanyl-1,3-thiazol-4-yl]-N-cycloheptyl-ethanamide

Systemtic Name: 2-[2-[2-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl]sulfanyl-1,3-thiazol-4-yl]-N-cycloheptyl-ethanamide Openeye Name: 2-[2-[2-(1,3-benzodioxol-5-yl)-2-oxo-ethyl]sulfanylthiazol-4-yl]-N-cycloheptyl-acetamide CAS Name: 2-[2-[[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]thio]-4-thiazolyl]-N-cycloheptylacetamide IUPAC Name: 2-[2-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]sulfanyl-1,3-thiazol-4-yl]-N-cycloheptylacetamide Traditional Name: 2-[2-[[2-(1,3-benzodioxol-5-yl)-2-keto-ethyl]thio]thiazol-4-yl]-N-cycloheptyl-acetamide Formula: C21H24N2O4S2 MolecularWeight: 432.55626

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)CC2=CSC(=N2)SCC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CCCC(CC1)NC(=O)CC2=CSC(=N2)SCC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H24N2O4S2/c24-17(14-7-8-18-19(9-14)27-13-26-18)12-29-21-23-16(11-28-21)10-20(25)22-15-5-3-1-2-4-6-15/h7-9,11,15H,1-6,10,12-13H2,(H,22,25)