Chem
J-GLOBAL ID:200907058927518404
Nikkaji number:J1.626.434B
Hexakis[[3-(10H-phenothiazine-10-yl)propyl]thio]benzene
ヘキサキス[[3-(10H-フェノチアジン-10-イル)プロピル]チオ]ベンゼン
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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:
C96 H84 N6 S12
Molecular formula furigana:
C96-H84-N6-S12
Molecular weight:
1706.490
InChI:
InChI=1S/C96H84N6S12/c1-13-43-79-67(31-1)97(68-32-2-14-44-80(68)109-79)55-25-61-103-91-92(104-62-26-56-98-69-33-3-15-45-81(69)110-82-46-16-4-34-70(82)98)94(106-64-28-58-100-73-37-7-19-49-85(73)112-86-50-20-8-38-74(86)100)96(108-66-30-60-102-77-41-11-23-53-89(77)114-90-54-24-12-42-78(90)102)95(107-65-29-59-101-75-39-9-21-51-87(75)113-88-52-22-10-40-76(88)101)93(91)105-63-27-57-99-71-35-5-17-47-83(71)111-84-48-18-6-36-72(84)99/h1-24,31-54H,25-30,55-66H2
InChI key:
OORDXRAYQKLRGN-UHFFFAOYSA-N
SMILES:
C(CSc1c(SCCCN2c3ccccc3Sc3ccccc23)c(SCCCN2c3ccccc3Sc3ccccc23)c(SCCCN2c3ccccc3Sc3ccccc23)c(SCCCN2c3ccccc3Sc3ccccc23)c1SCCCN1c2ccccc2Sc2ccccc12)CN1c2ccccc2Sc2ccccc12
Systematic name (3):
ヘキサキス[[3-(10H-フェノチアジン-10-イル)プロピル]チオ]ベンゼン
10-(3-{[2,3,4,5,6-ペンタキス({[3-(10H-フェノチアジン-10-イル)プロピル]スルファニル})フェニル]スルファニル}プロピル)-10H-フェノチアジン
10-(3-{[2,3,4,5,6-pentakis({[3-(10H-phenothiazin-10-yl)propyl]sulfanyl})phenyl]sulfanyl}propyl)-10H-phenothiazine
Other name (1):
Hexakis[[3-(10H-phenothiazine-10-yl)propyl]thio]benzene
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