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

Systemtic Name: 1-(3,4-dimethylphenyl)-5-[(piperidin-1-ylamino)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 1-(3,4-dimethylphenyl)-5-[(1-piperidylamino)methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 1-(3,4-dimethylphenyl)-5-[(1-piperidinylamino)methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-(3,4-dimethylphenyl)-5-[(piperidin-1-ylamino)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 1-(3,4-dimethylphenyl)-5-[(piperidinoamino)methylene]barbituric acid Formula: C18H22N4O3 MolecularWeight: 342.39228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C(=CNN3CCCCC3)C(=O)NC2=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C(=CNN3CCCCC3)C(=O)NC2=O)C

InChI

InChI=1S/C18H22N4O3/c1-12-6-7-14(10-13(12)2)22-17(24)15(16(23)20-18(22)25)11-19-21-8-4-3-5-9-21/h6-7,10-11,19H,3-5,8-9H2,1-2H3,(H,20,23,25)