5-[(3-oxidanylpropylamino)methylidene]-1-(phenylmethyl)-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[(3-oxidanylpropylamino)methylidene]-1-(phenylmethyl)-1,3-diazinane-2,4,6-trione Openeye Name: 1-benzyl-5-[(3-hydroxypropylamino)methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 5-[(3-hydroxypropylamino)methylidene]-1-(phenylmethyl)-1,3-diazinane-2,4,6-trione IUPAC Name: 1-benzyl-5-[(3-hydroxypropylamino)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 1-benzyl-5-[(3-hydroxypropylamino)methylene]barbituric acid Formula: C15H17N3O4 MolecularWeight: 303.31318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C(=CNCCCO)C(=O)NC2=O

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C(=CNCCCO)C(=O)NC2=O

InChI

InChI=1S/C15H17N3O4/c19-8-4-7-16-9-12-13(20)17-15(22)18(14(12)21)10-11-5-2-1-3-6-11/h1-3,5-6,9,16,19H,4,7-8,10H2,(H,17,20,22)