5-(azanylmethylidene)-1-(4-methylphenyl)-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-(azanylmethylidene)-1-(4-methylphenyl)-1,3-diazinane-2,4,6-trione Openeye Name: 5-(aminomethylene)-1-(p-tolyl)hexahydropyrimidine-2,4,6-trione CAS Name: 5-(aminomethylidene)-1-(4-methylphenyl)-1,3-diazinane-2,4,6-trione IUPAC Name: 5-(aminomethylidene)-1-(4-methylphenyl)-1,3-diazinane-2,4,6-trione Traditional Name: 5-(aminomethylene)-1-(p-tolyl)barbituric acid Formula: C12H11N3O3 MolecularWeight: 245.23404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C(=CN)C(=O)NC2=O

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C(=CN)C(=O)NC2=O

InChI

InChI=1S/C12H11N3O3/c1-7-2-4-8(5-3-7)15-11(17)9(6-13)10(16)14-12(15)18/h2-6H,13H2,1H3,(H,14,16,18)