1-(4-chlorophenyl)-5-[(octylamino)methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 1-(4-chlorophenyl)-5-[(octylamino)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 1-(4-chlorophenyl)-5-[(octylamino)methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 1-(4-chlorophenyl)-5-[(octylamino)methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-(4-chlorophenyl)-5-[(octylamino)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 1-(4-chlorophenyl)-5-[(octylamino)methylene]barbituric acid Formula: C19H24ClN3O3 MolecularWeight: 377.86516

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC=C1C(=O)NC(=O)N(C1=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCCCCCCCNC=C1C(=O)NC(=O)N(C1=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H24ClN3O3/c1-2-3-4-5-6-7-12-21-13-16-17(24)22-19(26)23(18(16)25)15-10-8-14(20)9-11-15/h8-11,13,21H,2-7,12H2,1H3,(H,22,24,26)