Chem
J-GLOBAL ID:201307007576039660
Nikkaji number:J3.210.930F
3-[1-(4-Fluorobenzyl)-2-oxo-4-hydroxy-6-fluoro-1,2-dihydroquinoline-3-yl]-7-(mesylamino)-4H-1,4-benzothiazine 1,1-dioxide
3-[1-(4-フルオロベンジル)-2-オキソ-4-ヒドロキシ-6-フルオロ-1,2-ジヒドロキノリン-3-イル]-7-(メシルアミノ)-4H-1,4-ベンゾチアジン1,1-ジオキシド
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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:
C25 H19 F2 N3 O4 [O-]2 S[S+2]
Molecular formula furigana:
C25-H19-F2-N3-O6-S2
Molecular weight:
559.560
InChI:
InChI=1S/C25H19F2N3O6S2/c1-37(33,34)29-17-7-8-19-22(11-17)38(35,36)13-20(28-19)23-24(31)18-10-16(27)6-9-21(18)30(25(23)32)12-14-2-4-15(26)5-3-14/h2-11,13,28-29,31H,12H2,1H3
InChI key:
SNCZSOMZWKLZNB-UHFFFAOYSA-N
SMILES:
CS(=O)(=O)Nc1ccc2NC(=C[S+2]([O-])([O-])c2c1)c1c(O)c2cc(F)ccc2n(Cc2ccc(F)cc2)c1=O
Systematic name (3):
3-[1-(4-フルオロベンジル)-2-オキソ-4-ヒドロキシ-6-フルオロ-1,2-ジヒドロキノリン-3-イル]-7-(メシルアミノ)-4H-1,4-ベンゾチアジン1,1-ジオキシド
3-{6-フルオロ-1-[(4-フルオロフェニル)メチル]-4-ヒドロキシ-2-オキソ-1,2-ジヒドロキノリン-3-イル}-7-メタンスルホンアミド-1,4-ジヒドロ-1,4-ベンゾチアジン-1,1-ジイウム-1,1-ビス(オラート)
3-{6-fluoro-1-[(4-fluorophenyl)methyl]-4-hydroxy-2-oxo-1,2-dihydroquinolin-3-yl}-7-methanesulfonamido-1,4-dihydro-1,4-benzothiazine-1,1-diium-1,1-bis(olate)
Other name (1):
3-[1-(4-Fluorobenzyl)-2-oxo-4-hydroxy-6-fluoro-1,2-dihydroquinoline-3-yl]-7-(mesylamino)-4H-1,4-benzothiazine 1,1-dioxide
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