Chem
J-GLOBAL ID:201707009848604003
Nikkaji number:J3.561.754J
PU-WS-13
8-(3,5-ジクロロフェニルチオ)-9-[3-(イソプロピルアミノ)プロピル]-9H-プリン-6-アミン
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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:
C17 H20 Cl2 N6 S
Molecular formula furigana:
C17-H20-CL2-N6-S
Molecular weight:
411.350
InChI:
InChI=1S/C17H20Cl2N6S/c1-10(2)21-4-3-5-25-16-14(15(20)22-9-23-16)24-17(25)26-13-7-11(18)6-12(19)8-13/h6-10,21H,3-5H2,1-2H3,(H2,20,22,23)
InChI key:
JYSLFQTWNRYWJT-UHFFFAOYSA-N
SMILES:
CC(C)NCCCn1c(Sc2cc(Cl)cc(Cl)c2)nc2c(N)ncnc12
Systematic name (4):
8-(3,5-ジクロロフェニルチオ)-9-[3-(イソプロピルアミノ)プロピル]-9H-プリン-6-アミン
9-[3-(イソプロピルアミノ)プロピル]-8-(3,5-ジクロロフェニルチオ)-9H-プリン-6-アミン
8-[(3,5-ジクロロフェニル)スルファニル]-9-{3-[(プロパン-2-イル)アミノ]プロピル}-9H-プリン-6-アミン
8-[(3,5-dichlorophenyl)sulfanyl]-9-{3-[(propan-2-yl)amino]propyl}-9H-purin-6-amine
Other name (3):
8-(3,5-Dichlorophenylthio)-9-[3-(isopropylamino)propyl]-9H-purine-6-amine
9-[3-(Isopropylamino)propyl]-8-(3,5-dichlorophenylthio)-9H-purine-6-amine
PU-WS-13
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