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

Systemtic Name: 5-[(azepan-1-ylamino)methylidene]-1-(2,5-dimethoxyphenyl)-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(azepan-1-ylamino)methylene]-1-(2,5-dimethoxyphenyl)hexahydropyrimidine-2,4,6-trione CAS Name: 5-[(1-azepanylamino)methylidene]-1-(2,5-dimethoxyphenyl)-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(azepan-1-ylamino)methylidene]-1-(2,5-dimethoxyphenyl)-1,3-diazinane-2,4,6-trione Traditional Name: 5-[(azepan-1-ylamino)methylene]-1-(2,5-dimethoxyphenyl)barbituric acid Formula: C19H24N4O5 MolecularWeight: 388.41766

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)N2C(=O)C(=CNN3CCCCCC3)C(=O)NC2=O

Isomeric SMILES

COC1=CC(=C(C=C1)OC)N2C(=O)C(=CNN3CCCCCC3)C(=O)NC2=O

InChI

InChI=1S/C19H24N4O5/c1-27-13-7-8-16(28-2)15(11-13)23-18(25)14(17(24)21-19(23)26)12-20-22-9-5-3-4-6-10-22/h7-8,11-12,20H,3-6,9-10H2,1-2H3,(H,21,24,26)