Chem
J-GLOBAL ID:201807013720739695
Nikkaji number:J3.682.079I
2-(Methylthio)-4-chloro-5-(4-chlorophenyl)-9-methyl-8,9-dihydropyrimido[4,5-e][1,4]oxazepine-7(5H)-one
2-(メチルチオ)-4-クロロ-5-(4-クロロフェニル)-9-メチル-8,9-ジヒドロピリミド[4,5-e][1,4]オキサゼピン-7(5H)-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:
C15 H13 Cl2 N3 O2 S
Molecular formula furigana:
C15-H13-CL2-N3-O2-S
Molecular weight:
370.250
InChI:
InChI=1S/C15H13Cl2N3O2S/c1-20-7-10(21)22-12(8-3-5-9(16)6-4-8)11-13(17)18-15(23-2)19-14(11)20/h3-6,12H,7H2,1-2H3
InChI key:
MOGUNWMSQZVJTK-UHFFFAOYSA-N
SMILES:
CSc1nc(Cl)c2C(OC(=O)CN(C)c2n1)c1ccc(Cl)cc1
Systematic name (3):
2-(メチルチオ)-4-クロロ-5-(4-クロロフェニル)-9-メチル-8,9-ジヒドロピリミド[4,5-e][1,4]オキサゼピン-7(5H)-オン
4-クロロ-5-(4-クロロフェニル)-9-メチル-2-(メチルスルファニル)-5H,7H,8H,9H-ピリミド[4,5-e][1,4]オキサゼピン-7-オン
4-chloro-5-(4-chlorophenyl)-9-methyl-2-(methylsulfanyl)-5H,7H,8H,9H-pyrimido[4,5-e][1,4]oxazepin-7-one
Other name (1):
2-(Methylthio)-4-chloro-5-(4-chlorophenyl)-9-methyl-8,9-dihydropyrimido[4,5-e][1,4]oxazepine-7(5H)-one
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