1-butyl-5-[(4-pyrrolidin-1-ylphenyl)methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 1-butyl-5-[(4-pyrrolidin-1-ylphenyl)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 1-butyl-5-[(4-pyrrolidin-1-ylphenyl)methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 1-butyl-5-[[4-(1-pyrrolidinyl)phenyl]methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-butyl-5-[(4-pyrrolidin-1-ylphenyl)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 1-butyl-5-(4-pyrrolidinobenzylidene)barbituric acid Formula: C19H23N3O3 MolecularWeight: 341.40422

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(=CC2=CC=C(C=C2)N3CCCC3)C(=O)NC1=O

Isomeric SMILES

CCCCN1C(=O)C(=CC2=CC=C(C=C2)N3CCCC3)C(=O)NC1=O

InChI

InChI=1S/C19H23N3O3/c1-2-3-12-22-18(24)16(17(23)20-19(22)25)13-14-6-8-15(9-7-14)21-10-4-5-11-21/h6-9,13H,2-5,10-12H2,1H3,(H,20,23,25)