Chem
J-GLOBAL ID:200907000175696512
Nikkaji number:J992.979G
2-Chloro-5-methyl-8-[(2-pyrimidinyl)thiomethyl]-11-ethyl-5,11-dihydro-6H-dipyrido[3,2-b:2′,3′-e][1,4]diazepine-6-one
2-クロロ-5-メチル-8-[(2-ピリミジニル)チオメチル]-11-エチル-5,11-ジヒドロ-6H-ジピリド[3,2-b:2′,3′-e][1,4]ジアゼピン-6-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:
C19 H17 ClN6 OS
Molecular formula furigana:
C19-H17-CL-N6-O-S
Molecular weight:
412.900
InChI:
InChI=1S/C19H17ClN6OS/c1-3-26-16-13(18(27)25(2)14-5-6-15(20)24-17(14)26)9-12(10-23-16)11-28-19-21-7-4-8-22-19/h4-10H,3,11H2,1-2H3
InChI key:
RBFYUIXVWQHOIR-UHFFFAOYSA-N
SMILES:
CCn1c2nc(Cl)ccc2n(C)c(=O)c2cc(CSc3ncccn3)cnc12
Systematic name (3):
2-クロロ-5-メチル-8-[(2-ピリミジニル)チオメチル]-11-エチル-5,11-ジヒドロ-6H-ジピリド[3,2-b:2′,3′-e][1,4]ジアゼピン-6-オン
5-クロロ-2-エチル-9-メチル-13-[(ピリミジン-2-イルスルファニル)メチル]-2,4,9,15-テトラアザトリシクロ[9.4.0.03,8 ]ペンタデカ-1(15),3,5,7,11,13-ヘキサエン-10-オン
5-chloro-2-ethyl-9-methyl-13-[(pyrimidin-2-ylsulfanyl)methyl]-2,4,9,15-tetraazatricyclo[9.4.0.03,8 ]pentadeca-1(15),3,5,7,11,13-hexaen-10-one
Other name (1):
2-Chloro-5-methyl-8-[(2-pyrimidinyl)thiomethyl]-11-ethyl-5,11-dihydro-6H-dipyrido[3,2-b:2′,3′-e][1,4]diazepine-6-one
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