Chem
J-GLOBAL ID:200907004990605039
Nikkaji number:J1.206.317B
1-[[3-[4-(2-Carbamoylphenyl)-1-piperazinyl]propyl]carbamoyl]-2-oxo-4-methyl-6-(3,4,5-trifluorophenyl)-1,2,3,6-tetrahydropyrimidine-5-carboxylic acid methyl ester
1-[[3-[4-(2-カルバモイルフェニル)-1-ピペラジニル]プロピル]カルバモイル]-2-オキソ-4-メチル-6-(3,4,5-トリフルオロフェニル)-1,2,3,6-テトラヒドロピリミジン-5-カルボン酸メチル
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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:
C28 H31 F3 N6 O5
Molecular formula furigana:
C28-H31-F3-N6-O5
Molecular weight:
588.588
InChI:
InChI=1S/C28H31F3N6O5/c1-16-22(26(39)42-2)24(17-14-19(29)23(31)20(30)15-17)37(28(41)34-16)27(40)33-8-5-9-35-10-12-36(13-11-35)21-7-4-3-6-18(21)25(32)38/h3-4,6-7,14-15,24H,5,8-13H2,1-2H3,(H2,32,38)(H,33,40)(H,34,41)
InChI key:
CMSFKMOGRSBIOR-UHFFFAOYSA-N
SMILES:
COC(=O)C1=C(C)NC(=O)N(C1c1cc(F)c(F)c(F)c1)C(=O)NCCCN1CCN(CC1)c1ccccc1C(=O)N
Systematic name (3):
1-[[3-[4-(2-カルバモイルフェニル)-1-ピペラジニル]プロピル]カルバモイル]-2-オキソ-4-メチル-6-(3,4,5-トリフルオロフェニル)-1,2,3,6-テトラヒドロピリミジン-5-カルボン酸メチル
メチル 3-({3-[4-(2-カルバモイルフェニル)ピペラジン-1-イル]プロピル}カルバモイル)-6-メチル-2-オキソ-4-(3,4,5-トリフルオロフェニル)-1,2,3,4-テトラヒドロピリミジン-5-カルボキシラート
methyl 3-({3-[4-(2-carbamoylphenyl)piperazin-1-yl]propyl}carbamoyl)-6-methyl-2-oxo-4-(3,4,5-trifluorophenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Other name (1):
1-[[3-[4-(2-Carbamoylphenyl)-1-piperazinyl]propyl]carbamoyl]-2-oxo-4-methyl-6-(3,4,5-trifluorophenyl)-1,2,3,6-tetrahydropyrimidine-5-carboxylic acid methyl ester
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