1-butyl-5-[(1-propyl-3,4-dihydro-2H-quinolin-6-yl)methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 1-butyl-5-[(1-propyl-3,4-dihydro-2H-quinolin-6-yl)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 1-butyl-5-[(1-propyl-3,4-dihydro-2H-quinolin-6-yl)methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 1-butyl-5-[(1-propyl-3,4-dihydro-2H-quinolin-6-yl)methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-butyl-5-[(1-propyl-3,4-dihydro-2H-quinolin-6-yl)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 1-butyl-5-[(1-propyl-3,4-dihydro-2H-quinolin-6-yl)methylene]barbituric acid Formula: C21H27N3O3 MolecularWeight: 369.45738

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(=CC2=CC3=C(C=C2)N(CCC3)CCC)C(=O)NC1=O

Isomeric SMILES

CCCCN1C(=O)C(=CC2=CC3=C(C=C2)N(CCC3)CCC)C(=O)NC1=O

InChI

InChI=1S/C21H27N3O3/c1-3-5-12-24-20(26)17(19(25)22-21(24)27)14-15-8-9-18-16(13-15)7-6-11-23(18)10-4-2/h8-9,13-14H,3-7,10-12H2,1-2H3,(H,22,25,27)