1-(2,5-dimethoxyphenyl)-5-[(3-piperidin-1-ylpropylamino)methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 1-(2,5-dimethoxyphenyl)-5-[(3-piperidin-1-ylpropylamino)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 1-(2,5-dimethoxyphenyl)-5-[[3-(1-piperidyl)propylamino]methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 1-(2,5-dimethoxyphenyl)-5-[[3-(1-piperidinyl)propylamino]methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-(2,5-dimethoxyphenyl)-5-[(3-piperidin-1-ylpropylamino)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 1-(2,5-dimethoxyphenyl)-5-[(3-piperidinopropylamino)methylene]barbituric acid Formula: C21H28N4O5 MolecularWeight: 416.47082

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)N2C(=O)C(=CNCCCN3CCCCC3)C(=O)NC2=O

Isomeric SMILES

COC1=CC(=C(C=C1)OC)N2C(=O)C(=CNCCCN3CCCCC3)C(=O)NC2=O

InChI

InChI=1S/C21H28N4O5/c1-29-15-7-8-18(30-2)17(13-15)25-20(27)16(19(26)23-21(25)28)14-22-9-6-12-24-10-4-3-5-11-24/h7-8,13-14,22H,3-6,9-12H2,1-2H3,(H,23,26,28)