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

Systemtic Name: (5Z)-1-butyl-5-[(4-dimethylaminophenyl)methylidene]-3-octyl-1,3-diazinane-2,4,6-trione Openeye Name: (5Z)-1-butyl-5-[(4-dimethylaminophenyl)methylene]-3-octyl-hexahydropyrimidine-2,4,6-trione CAS Name: (5Z)-1-butyl-5-[(4-dimethylaminophenyl)methylidene]-3-octyl-1,3-diazinane-2,4,6-trione IUPAC Name: (5Z)-1-butyl-5-[(4-dimethylaminophenyl)methylidene]-3-octyl-1,3-diazinane-2,4,6-trione Traditional Name: (5Z)-1-butyl-5-[4-(dimethylamino)benzylidene]-3-octyl-barbituric acid Formula: C25H37N3O3 MolecularWeight: 427.57958

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C(=O)C(=CC2=CC=C(C=C2)N(C)C)C(=O)N(C1=O)CCCC

Isomeric SMILES

CCCCCCCCN1C(=O)/C(=C\C2=CC=C(C=C2)N(C)C)/C(=O)N(C1=O)CCCC

InChI

InChI=1S/C25H37N3O3/c1-5-7-9-10-11-12-18-28-24(30)22(23(29)27(25(28)31)17-8-6-2)19-20-13-15-21(16-14-20)26(3)4/h13-16,19H,5-12,17-18H2,1-4H3/b22-19-