Chem
J-GLOBAL ID:200907005204542211
Nikkaji number:J1.845.566H
1-(2,6-Dichlorophenyl)-5-(2-chloro-4-fluorophenyl)-7-(1-isopropyl-4-piperidinyl)-1,2,3,4-tetrahydroquinazoline-2-one
1-(2,6-ジクロロフェニル)-5-(2-クロロ-4-フルオロフェニル)-7-(1-イソプロピル-4-ピペリジニル)-1,2,3,4-テトラヒドロキナゾリン-2-オン
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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:
C28 H27 Cl3 FN3 O
Molecular formula furigana:
C28-H27-CL3-F-N3-O
Molecular weight:
546.890
InChI:
InChI=1S/C28H27Cl3FN3O/c1-16(2)34-10-8-17(9-11-34)18-12-21(20-7-6-19(32)14-25(20)31)22-15-33-28(36)35(26(22)13-18)27-23(29)4-3-5-24(27)30/h3-7,12-14,16-17H,8-11,15H2,1-2H3,(H,33,36)
InChI key:
KXNNHYBPDFMKQK-UHFFFAOYSA-N
SMILES:
CC(C)N1CCC(CC1)c1cc2N(C(=O)NCc2c(c1)c1ccc(F)cc1Cl)c1c(Cl)cccc1Cl
Systematic name (3):
1-(2,6-ジクロロフェニル)-5-(2-クロロ-4-フルオロフェニル)-7-(1-イソプロピル-4-ピペリジニル)-1,2,3,4-テトラヒドロキナゾリン-2-オン
5-(2-クロロ-4-フルオロフェニル)-1-(2,6-ジクロロフェニル)-7-[1-(プロパン-2-イル)ピペリジン-4-イル]-1,2,3,4-テトラヒドロキナゾリン-2-オン
5-(2-chloro-4-fluorophenyl)-1-(2,6-dichlorophenyl)-7-[1-(propan-2-yl)piperidin-4-yl]-1,2,3,4-tetrahydroquinazolin-2-one
Other name (1):
1-(2,6-Dichlorophenyl)-5-(2-chloro-4-fluorophenyl)-7-(1-isopropyl-4-piperidinyl)-1,2,3,4-tetrahydroquinazoline-2-one
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