Chem
J-GLOBAL ID:200907070767875060
Nikkaji number:J1.099.583C
1,1′-[(1R,2R)-Cyclohexane-1,2-diyl]bis[3-[3-(2-thienyl)propyl]urea]
1,1′-[(1R,2R)-シクロヘキサン-1,2-ジイル]ビス[3-[3-(2-チエニル)プロピル]尿素]
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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:
C22 H32 N4 O2 S2
Molecular formula furigana:
C22-H32-N4-O2-S2
Molecular weight:
448.640
InChI:
InChI=1S/C22H32N4O2S2/c27-21(23-13-3-7-17-9-5-15-29-17)25-19-11-1-2-12-20(19)26-22(28)24-14-4-8-18-10-6-16-30-18/h5-6,9-10,15-16,19-20H,1-4,7-8,11-14H2,(H2,23,25,27)(H2,24,26,28)/t19-,20-/m1/s1
InChI key:
IWIJLKDPHYTMIO-WOJBJXKFSA-N
SMILES:
O=C(NCCCc1cccs1)N[C@@H]1CCCC[C@H]1NC(=O)NCCCc1cccs1
Systematic name (3):
1,1′-[(1R,2R)-シクロヘキサン-1,2-ジイル]ビス[3-[3-(2-チエニル)プロピル]尿素]
3-[3-(チオフェン-2-イル)プロピル]-1-[(1R,2R)-2-({[3-(チオフェン-2-イル)プロピル]カルバモイル}アミノ)シクロヘキシル]尿素
3-[3-(thiophen-2-yl)propyl]-1-[(1R,2R)-2-({[3-(thiophen-2-yl)propyl]carbamoyl}amino)cyclohexyl]urea
Other name (1):
1,1′-[(1R,2R)-Cyclohexane-1,2-diyl]bis[3-[3-(2-thienyl)propyl]urea]
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