Chem
J-GLOBAL ID：201207015297745584   Nikkaji number：J3.077.169I

1-[(R)-2-Methyl-3,6,9-trioxadecane-1-yl]-1′-propyl[1,1′-(1,3-phenylene)bis[3-propyl-3-[3-(1,3-dipropyl-3-phenylureido)phenyl]urea]]

1-[(R)-2-メチル-3,6,9-トリオキサデカン-1-イル]-1′-プロピル[1,1′-(1,3-フェニレン)ビス[3-プロピル-3-[3-(1,3-ジプロピル-3-フェニルウレイド)フェニル]尿素]]
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： C63H88N8O7
Molecular formula furigana： C63-H88-N8-O7
Molecular weight： 1069.446
InChI： InChI=1S/C63H88N8O7/c1-10-36-64(52-26-19-17-20-27-52)60(72)66(38-12-3)54-30-23-32-56(47-54)68(40-14-5)62(74)69(41-15-6)58-34-25-35-59(49-58)71(50-51(8)78-46-45-77-44-43-76-9)63(75)70(42-16-7)57-33-24-31-55(48-57)67(39-13-4)61(73)65(37-11-2)53-28-21-18-22-29-53/h17-35,47-49,51H,10-16,36-46,50H2,1-9H3/t51-/m1/s1
InChI key： QLHJORYVMBWFJI-NLXJDERGSA-N
SMILES： CCCN(C(=O)N(CCC)c1cccc(c1)N(CCC)C(=O)N(CCC)c1cccc(c1)N(C[C@@H](C)OCCOCCOC)C(=O)N(CCC)c1cccc(c1)N(CCC)C(=O)N(CCC)c1ccccc1)c1ccccc1
Systematic name  (3)：
  • 1-[(R)-2-メチル-3,6,9-トリオキサデカン-1-イル]-1′-プロピル[1,1′-(1,3-フェニレン)ビス[3-プロピル-3-[3-(1,3-ジプロピル-3-フェニルウレイド)フェニル]尿素]]
  • 1-{3-[(3R)-3-メチル-1-[(3-{[フェニル(プロピル)カルバモイル](プロピル)アミノ}フェニル)(プロピル)カルバモイル]-4,7,10-トリオキサ-1-アザウンデカン-1-イル]フェニル}-3-(3-{[フェニル(プロピル)カルバモイル](プロピル)アミノ}フェニル)-1,3-ジプロピル尿素
  • 1-{3-[(3R)-3-methyl-1-[(3-{[phenyl(propyl)carbamoyl](propyl)amino}phenyl)(propyl)carbamoyl]-4,7,10-trioxa-1-azaundecan-1-yl]phenyl}-3-(3-{[phenyl(propyl)carbamoyl](propyl)amino}phenyl)-1,3-dipropylurea
Other name (1)：
  • 1-[(R)-2-Methyl-3,6,9-trioxadecane-1-yl]-1′-propyl[1,1′-(1,3-phenylene)bis[3-propyl-3-[3-(1,3-dipropyl-3-phenylureido)phenyl]urea]]
Thsaurus map：
Thesaurus Map

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