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

Systemtic Name: 1-butyl-5-[(octylamino)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 1-butyl-5-[(octylamino)methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 1-butyl-5-[(octylamino)methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-butyl-5-[(octylamino)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 1-butyl-5-[(octylamino)methylene]barbituric acid Formula: C17H29N3O3 MolecularWeight: 323.43046

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC=C1C(=O)NC(=O)N(C1=O)CCCC

Isomeric SMILES

CCCCCCCCNC=C1C(=O)NC(=O)N(C1=O)CCCC

InChI

InChI=1S/C17H29N3O3/c1-3-5-7-8-9-10-11-18-13-14-15(21)19-17(23)20(16(14)22)12-6-4-2/h13,18H,3-12H2,1-2H3,(H,19,21,23)