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

Systemtic Name: 5-[bis(azanyl)methylidene]-1-butyl-3-(5-phenylpentyl)-1,3-diazinane-2,4,6-trione Openeye Name: 1-butyl-5-(diaminomethylene)-3-(5-phenylpentyl)hexahydropyrimidine-2,4,6-trione CAS Name: 1-butyl-5-(diaminomethylidene)-3-(5-phenylpentyl)-1,3-diazinane-2,4,6-trione IUPAC Name: 1-butyl-5-(diaminomethylidene)-3-(5-phenylpentyl)-1,3-diazinane-2,4,6-trione Traditional Name: 1-butyl-5-(diaminomethylene)-3-(5-phenylpentyl)barbituric acid Formula: C20H28N4O3 MolecularWeight: 372.46132

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(=C(N)N)C(=O)N(C1=O)CCCCCC2=CC=CC=C2

Isomeric SMILES

CCCCN1C(=O)C(=C(N)N)C(=O)N(C1=O)CCCCCC2=CC=CC=C2

InChI

InChI=1S/C20H28N4O3/c1-2-3-13-23-18(25)16(17(21)22)19(26)24(20(23)27)14-9-5-8-12-15-10-6-4-7-11-15/h4,6-7,10-11H,2-3,5,8-9,12-14,21-22H2,1H3