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

Systemtic Name: 5-[(3-imidazol-1-ylpropylamino)methylidene]-1-phenyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(3-imidazol-1-ylpropylamino)methylene]-1-phenyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-[[3-(1-imidazolyl)propylamino]methylidene]-1-phenyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(3-imidazol-1-ylpropylamino)methylidene]-1-phenyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-[(3-imidazol-1-ylpropylamino)methylene]-1-phenyl-barbituric acid Formula: C17H17N5O3 MolecularWeight: 339.34858

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C(=CNCCCN3C=CN=C3)C(=O)NC2=O

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C(=CNCCCN3C=CN=C3)C(=O)NC2=O

InChI

InChI=1S/C17H17N5O3/c23-15-14(11-18-7-4-9-21-10-8-19-12-21)16(24)22(17(25)20-15)13-5-2-1-3-6-13/h1-3,5-6,8,10-12,18H,4,7,9H2,(H,20,23,25)