Chem
J-GLOBAL ID:201707011227069060
Nikkaji number:J3.612.197A
2,2′-[Pentamethylenebis(oxy 1,4-phenylene)]bis(1,4,5,6-tetrahydropyrimidine)
2,2′-[ペンタメチレンビス(オキシ1,4-フェニレン)]ビス(1,4,5,6-テトラヒドロピリミジン)
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Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C25 H32 N4 O2
Molecular formula furigana:
C25-H32-N4-O2
Molecular weight:
420.557
InChI:
InChI=1S/C25H32N4O2/c1(2-18-30-22-10-6-20(7-11-22)24-26-14-4-15-27-24)3-19-31-23-12-8-21(9-13-23)25-28-16-5-17-29-25/h6-13H,1-5,14-19H2,(H,26,27)(H,28,29)
InChI key:
KPYLNHFSSDNDFO-UHFFFAOYSA-N
SMILES:
C(CCOc1ccc(cc1)C1=NCCCN1)CCOc1ccc(cc1)C1=NCCCN1
Systematic name (3):
2,2′-[ペンタメチレンビス(オキシ1,4-フェニレン)]ビス(1,4,5,6-テトラヒドロピリミジン)
2-[4-({5-[4-(1,4,5,6-テトラヒドロピリミジン-2-イル)フェノキシ]ペンチル}オキシ)フェニル]-1,4,5,6-テトラヒドロピリミジン
2-[4-({5-[4-(1,4,5,6-tetrahydropyrimidin-2-yl)phenoxy]pentyl}oxy)phenyl]-1,4,5,6-tetrahydropyrimidine
Other name (1):
2,2′-[Pentamethylenebis(oxy 1,4-phenylene)]bis(1,4,5,6-tetrahydropyrimidine)
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