5-[1-(3-imidazol-1-ylpropylamino)ethylidene]-1-(2-methylphenyl)-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[1-(3-imidazol-1-ylpropylamino)ethylidene]-1-(2-methylphenyl)-1,3-diazinane-2,4,6-trione Openeye Name: 5-[1-(3-imidazol-1-ylpropylamino)ethylidene]-1-(o-tolyl)hexahydropyrimidine-2,4,6-trione CAS Name: 5-[1-[3-(1-imidazolyl)propylamino]ethylidene]-1-(2-methylphenyl)-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[1-(3-imidazol-1-ylpropylamino)ethylidene]-1-(2-methylphenyl)-1,3-diazinane-2,4,6-trione Traditional Name: 5-[1-(3-imidazol-1-ylpropylamino)ethylidene]-1-(o-tolyl)barbituric acid Formula: C19H21N5O3 MolecularWeight: 367.40174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C(=C(C)NCCCN3C=CN=C3)C(=O)NC2=O

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C(=C(C)NCCCN3C=CN=C3)C(=O)NC2=O

InChI

InChI=1S/C19H21N5O3/c1-13-6-3-4-7-15(13)24-18(26)16(17(25)22-19(24)27)14(2)21-8-5-10-23-11-9-20-12-23/h3-4,6-7,9,11-12,21H,5,8,10H2,1-2H3,(H,22,25,27)