Chem
J-GLOBAL ID:200907051249055429   Nikkaji number:J352.010B

(2S)-2-[2-Methoxy-4-[N-[(3,4-dihydro-2-methyl-4-oxoquinazolin)-6-ylmethyl]-N-ethylamino]benzoylamino]glutaric acid

(2S)-2-[(4-{エチル[(2-メチル-4-オキソ-3,4-ジヒドロキナゾリン-6-イル)メチル]アミノ}-2-メトキシフェニル)ホルムアミド]ペンタン二酸
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: C25H28N4O7
Molecular formula furigana: C25-H28-N4-O7
Molecular weight: 496.520
InChI: InChI=1S/C25H28N4O7/c1-4-29(13-15-5-8-19-18(11-15)24(33)27-14(2)26-19)16-6-7-17(21(12-16)36-3)23(32)28-20(25(34)35)9-10-22(30)31/h5-8,11-12,20H,4,9-10,13H2,1-3H3,(H,28,32)(H,30,31)(H,34,35)(H,26,27,33)/t20-/m0/s1
InChI key: APPDUCKVIFCUFC-FQEVSTJZSA-N
SMILES: CCN(Cc1ccc2nc(C)[nH]c(=O)c2c1)c1ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)c(OC)c1
Systematic name  (3):
  • (2S)-2-[2-メトキシ-4-[N-[(3,4-ジヒドロ-2-メチル-4-オキソキナゾリン)-6-イルメチル]-N-エチルアミノ]ベンゾイルアミノ]グルタル酸
  • (2S)-2-[(4-{エチル[(2-メチル-4-オキソ-3,4-ジヒドロキナゾリン-6-イル)メチル]アミノ}-2-メトキシフェニル)ホルムアミド]ペンタン二酸
  • (2S)-2-[(4-{ethyl[(2-methyl-4-oxo-3,4-dihydroquinazolin-6-yl)methyl]amino}-2-methoxyphenyl)formamido]pentanedioic acid
Other name (1):
  • (2S)-2-[2-Methoxy-4-[N-[(3,4-dihydro-2-methyl-4-oxoquinazolin)-6-ylmethyl]-N-ethylamino]benzoylamino]glutaric acid
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