(5S)-5-(3-oxidanylpropyliminomethyl)-1-(phenylmethyl)-1,3-diazinane-2,4,6-trione

Systemtic Name: (5S)-5-(3-oxidanylpropyliminomethyl)-1-(phenylmethyl)-1,3-diazinane-2,4,6-trione Openeye Name: (5S)-1-benzyl-5-(3-hydroxypropyliminomethyl)hexahydropyrimidine-2,4,6-trione CAS Name: (5S)-5-(3-hydroxypropyliminomethyl)-1-(phenylmethyl)-1,3-diazinane-2,4,6-trione IUPAC Name: (5S)-1-benzyl-5-(3-hydroxypropyliminomethyl)-1,3-diazinane-2,4,6-trione Traditional Name: (5S)-1-benzyl-5-(3-hydroxypropyliminomethyl)barbituric acid Formula: C15H17N3O4 MolecularWeight: 303.31318

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)[C@H](C(=O)NC2=O)C=NCCCO

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/h1-3,5-6,9,12,19H,4,7-8,10H2,(H,17,20,22)/t12-/m0/s1