Chem
J-GLOBAL ID:201407068168816298
Nikkaji number:J3.269.454C
2-[(S)-1-(5-Fluoropyrimidine-2-yl)ethylamino]-4-[(1-methyl-1H-imidazole-4-yl)amino]-7H-pyrrolo[2,3-d]pyrimidine
2-[(S)-1-(5-フルオロピリミジン-2-イル)エチルアミノ]-4-[(1-メチル-1H-イミダゾール-4-イル)アミノ]-7H-ピロロ[2,3-d]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:
C16 H16 FN9
Molecular formula furigana:
C16-H16-F-N9
Molecular weight:
353.365
InChI:
InChI=1S/C16H16FN9/c1-9(13-19-5-10(17)6-20-13)22-16-24-14-11(3-4-18-14)15(25-16)23-12-7-26(2)8-21-12/h3-9H,1-2H3,(H3,18,22,23,24,25)/t9-/m0/s1
InChI key:
QHXBWJSQXSYAGG-VIFPVBQESA-N
SMILES:
C[C@H](Nc1nc(Nc2cn(C)cn2)c2cc[nH]c2n1)c1ncc(F)cn1
Systematic name (3):
2-[(S)-1-(5-フルオロピリミジン-2-イル)エチルアミノ]-4-[(1-メチル-1H-イミダゾール-4-イル)アミノ]-7H-ピロロ[2,3-d]ピリミジン
N2-[(1S)-1-(5-フルオロピリミジン-2-イル)エチル]-N4-(1-メチル-1H-イミダゾール-4-イル)-7H-ピロロ[2,3-d]ピリミジン-2,4-ジアミン
N2-[(1S)-1-(5-fluoropyrimidin-2-yl)ethyl]-N4-(1-methyl-1H-imidazol-4-yl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine
Other name (1):
2-[(S)-1-(5-Fluoropyrimidine-2-yl)ethylamino]-4-[(1-methyl-1H-imidazole-4-yl)amino]-7H-pyrrolo[2,3-d]pyrimidine
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