AC1NKLAH
N-[3-[2-(3,4-dimethoxyphenyl)ethyl]-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]-2-ethylbutanamide
Also Known As: (Z)-N-(3-(3,4-dimethoxyphenethyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)-2-ethylbutanamide|N-[(2Z)-3-[2-(3,4-dimethoxyphenyl)ethyl]-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-ethylbutanamide|N-[3-[2-(3,4-Dimethoxy-phenyl)-ethyl]-5,5-dioxo-hexahydro-5lambda*6*-thieno[3,4-d]thiazol-(2Z)-yliden e]-2-ethyl-butyramide|N-[3-[2-(3,4-dimethoxyphenyl)ethyl]-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]-2-ethylbutanamide
| Molecular Formula | C21H30N2O5S2 |
|---|---|
| Molecular Weight | 454.1596 g/mol |
| LogP | 2.7795 |
| Topological Polar Surface Area | 85.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 454.1596 |
| Monoisotopic Mass | 454.1596 |
| Heavy Atoms | 30 |
| Complexity | 911.97186 |
Chemical Identifiers
| CAS Number | 896850-41-2 |
|---|---|
| SMILES | CCC(CC)C(=O)N=C1N(C2CS(=O)(=O)CC2S1)CCC3=CC(=C(C=C3)OC)OC |
Product Overview
AC1NKLAH (CAS 896850-41-2), with molecular formula C21H30N2O5S2 and molecular weight 454.1596 g/mol. IUPAC: N-[3-[2-(3,4-dimethoxyphenyl)ethyl]-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]-2-ethylbutanamide.
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