Chem
J-GLOBAL ID:201607014322826776
Nikkaji number:J3.471.231J
(R)-1-(2,4-Diamino-6-ethylpyrimidine-5-yl)-3-[3-methoxy-5-(4-pyridinyl)phenyl]-1-butyne
(R)-1-(2,4-ジアミノ-6-エチルピリミジン-5-イル)-3-[3-メトキシ-5-(4-ピリジニル)フェニル]-1-ブチン
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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:
C22 H23 N5 O
Molecular formula furigana:
C22-H23-N5-O
Molecular weight:
373.460
InChI:
InChI=1S/C22H23N5O/c1-4-20-19(21(23)27-22(24)26-20)6-5-14(2)16-11-17(13-18(12-16)28-3)15-7-9-25-10-8-15/h7-14H,4H2,1-3H3,(H4,23,24,26,27)/t14-/m0/s1
InChI key:
KEPLBUUTAQCZOE-AWEZNQCLSA-N
SMILES:
CCc1nc(N)nc(N)c1C#C[C@H](C)c1cc(OC)cc(c1)c1ccncc1
Systematic name (3):
(R)-1-(2,4-ジアミノ-6-エチルピリミジン-5-イル)-3-[3-メトキシ-5-(4-ピリジニル)フェニル]-1-ブチン
6-エチル-5-[(3R)-3-[3-メトキシ-5-(ピリジン-4-イル)フェニル]ブタ-1-イン-1-イル]ピリミジン-2,4-ジアミン
6-ethyl-5-[(3R)-3-[3-methoxy-5-(pyridin-4-yl)phenyl]but-1-yn-1-yl]pyrimidine-2,4-diamine
Other name (1):
(R)-1-(2,4-Diamino-6-ethylpyrimidine-5-yl)-3-[3-methoxy-5-(4-pyridinyl)phenyl]-1-butyne
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