1-(10H-Phenothiazin-10-yl)-2-{[4-phenyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-ethanone

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Systematic / IUPAC Name: 1-(10H-Phenothiazin-10-yl)-2-{[4-phenyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone

ID: Reference7008

Other Names: Ethanone, 1-(10H-phenothiazin-10-yl)-2-{[4-phenyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]thio}-

Formula: C27H19N5OS2

Spectral Data

1-(10H-Phenothiazin-10-yl)-2-{[4-phenyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-ethanone mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 119
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 11/21/2017 8:35:01 AM
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Identificators

InChI InChI=1S/C27H19N5OS2/c33-25(32-21-10-4-6-12-23(21)35-24-13-7-5-11-22(24)32)18-34-27-30-29-26(19-14-16-28-17-15-19)31(27)20-8-2-1-3-9-20/h1-17H,18H2
InChI Key IYYMBWXNENQWAH-UHFFFAOYSA-N
Canonical SMILES C1=CC=C(C=C1)N2C(=NN=C2SCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53)C6=CC=NC=C6
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Other Names Ethanone, 1-(10H-phenothiazin-10-yl)-2-{[4-phenyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]thio}-

In Other Databases

PubChem 1142947
ChemSpider 971137