1-butyl-5-[[(4-fluorophenyl)amino]methylidene]-3-prop-2-enyl-1,3-diazinane-2,4,6-trione

Systemtic Name: 1-butyl-5-[[(4-fluorophenyl)amino]methylidene]-3-prop-2-enyl-1,3-diazinane-2,4,6-trione Openeye Name: 1-allyl-3-butyl-5-[(4-fluoroanilino)methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 1-butyl-5-[(4-fluoroanilino)methylidene]-3-prop-2-enyl-1,3-diazinane-2,4,6-trione IUPAC Name: 1-butyl-5-[(4-fluoroanilino)methylidene]-3-prop-2-enyl-1,3-diazinane-2,4,6-trione Traditional Name: 1-allyl-3-butyl-5-[(4-fluoroanilino)methylene]barbituric acid Formula: C18H20FN3O3 MolecularWeight: 345.368103

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(=CNC2=CC=C(C=C2)F)C(=O)N(C1=O)CC=C

Isomeric SMILES

CCCCN1C(=O)C(=CNC2=CC=C(C=C2)F)C(=O)N(C1=O)CC=C

InChI

InChI=1S/C18H20FN3O3/c1-3-5-11-22-17(24)15(16(23)21(10-4-2)18(22)25)12-20-14-8-6-13(19)7-9-14/h4,6-9,12,20H,2-3,5,10-11H2,1H3