1-tert-butyl-5-[(1-butyl-2,3-dihydroindol-5-yl)methylidene]-1,3-diazinane-2,4,6-trione

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCC2=C1C=CC(=C2)C=C3C(=O)NC(=O)N(C3=O)C(C)(C)C

Isomeric SMILES

CCCCN1CCC2=C1C=CC(=C2)C=C3C(=O)NC(=O)N(C3=O)C(C)(C)C

InChI

InChI=1S/C21H27N3O3/c1-5-6-10-23-11-9-15-12-14(7-8-17(15)23)13-16-18(25)22-20(27)24(19(16)26)21(2,3)4/h7-8,12-13H,5-6,9-11H2,1-4H3,(H,22,25,27)