Chem
J-GLOBAL ID:200907064930616697
Nikkaji number:J711.206H
Semapimod
セマピモド
Download MOL file
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:
C34 H52 N18 O2
Molecular formula furigana:
C34-H52-N18-O2
Molecular weight:
744.914
InChI:
InChI=1S/C34H52N18O2/c1-19(45-49-31(35)36)23-13-24(20(2)46-50-32(37)38)16-27(15-23)43-29(53)11-9-7-5-6-8-10-12-30(54)44-28-17-25(21(3)47-51-33(39)40)14-26(18-28)22(4)48-52-34(41)42/h13-18H,5-12H2,1-4H3,(H,43,53)(H,44,54)(H4,35,36,49)(H4,37,38,50)(H4,39,40,51)(H4,41,42,52)
InChI key:
PWDYHMBTPGXCSN-UHFFFAOYSA-N
SMILES:
CC(=NNC(=N)N)c1cc(NC(=O)CCCCCCCCC(=O)Nc2cc(cc(c2)C(=NNC(=N)N)C)C(=NNC(=N)N)C)cc(c1)C(=NNC(=N)N)C
Systematic name (4):
N,N′-ビス[3,5-ビス[1-(2-アミジノヒドラゾノ)エチル]フェニル]デカンジアミド
N,N′-ビス[3,5-ビス[1-[2-(アミノイミノメチル)ヒドラゾノ]エチル]フェニル]デカンジアミド
N,N'-ビス({3,5-ビス[1-(カルバムイミドアミドイミノ)エチル]フェニル})デカンジアミド
N,N'-bis({3,5-bis[1-(carbamimidamidoimino)ethyl]phenyl})decanediamide
Other name (4):
N,N′-Bis[3,5-bis[1-(2-amidinohydrazono)ethyl]phenyl]decanediamide
N,N′-Bis[3,5-bis[1-[2-(aminoiminomethyl)hydrazono]ethyl]phenyl]decanediamide
Semapimod
セマピモド
CAS registry number:
352513-83-8
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