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2-[2-(2-chloranylphenothiazin-10-yl)-2-oxidanylidene-ethyl]sulfanyl-4,6-dimethyl-pyridine-3-carbonitrile
SpectraBase Compound ID AdSNkk4LNBb
InChI InChI=1S/C22H16ClN3OS2/c1-13-9-14(2)25-22(16(13)11-24)28-12-21(27)26-17-5-3-4-6-19(17)29-20-8-7-15(23)10-18(20)26/h3-10H,12H2,1-2H3
InChIKey GKFBVCFBFCUTNX-UHFFFAOYSA-N
Mol Weight 437.96 g/mol
Molecular Formula C22H16ClN3OS2
Exact Mass 437.042332 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B1Da3A0zDkG
Name 2-[2-(2-chloranylphenothiazin-10-yl)-2-oxidanylidene-ethyl]sulfanyl-4,6-dimethyl-pyridine-3-carbonitrile
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Formula C22H16ClN3OS2
InChI InChI=1S/C22H16ClN3OS2/c1-13-9-14(2)25-22(16(13)11-24)28-12-21(27)26-17-5-3-4-6-19(17)29-20-8-7-15(23)10-18(20)26/h3-10H,12H2,1-2H3
InChIKey GKFBVCFBFCUTNX-UHFFFAOYSA-N
Molecular Weight 437.963 g/mol
SMILES c1ccc2N(c3c(ccc(c3)Cl)Sc2c1)C(CSc1c(c(C)cc(n1)C)C#N)=O
SPLASH splash10-0560-4960000000-6bf4667e09e93a70de1c
Source of Spectrum AD-0-2532-0
Synonyms 2-[2-(2-chlorophenothiazin-10-yl)-2-oxo-ethyl]sulfanyl-4,6-dimethyl-pyridine-3-carbonitrile 2-[[2-(2-chloro-10-phenothiazinyl)-2-oxoethyl]thio]-4,6-dimethyl-3-pyridinecarbonitrile 2-[[2-(2-chlorophenothiazin-10-yl)-2-keto-ethyl]thio]-4,6-dimethyl-nicotinonitrile
Wiley ID 1435971