2-[1-methyl-5-(3-oxidanylidene-4H-1,4-benzothiazin-2-yl)pyrrol-2-yl]-4H-1,4-benzothiazin-3-one

SpectraBase Compound ID	EbJPoNHiGIX
InChI	InChI=1S/C21H17N3O2S2/c1-24-14(18-20(25)22-12-6-2-4-8-16(12)27-18)10-11-15(24)19-21(26)23-13-7-3-5-9-17(13)28-19/h2-11,18-19H,1H3,(H,22,25)(H,23,26)
InChIKey	YVYPZZKMPZYZJS-UHFFFAOYSA-N Google Search
Mol Weight	407.51 g/mol
Molecular Formula	C21H17N3O2S2
Exact Mass	407.076219 g/mol

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SpectraBase Spectrum ID	B6rCSlb88DH
Name	2-[1-methyl-5-(3-oxidanylidene-4H-1,4-benzothiazin-2-yl)pyrrol-2-yl]-4H-1,4-benzothiazin-3-one
Copyright	Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C21H17N3O2S2
InChI	InChI=1S/C21H17N3O2S2/c1-24-14(18-20(25)22-12-6-2-4-8-16(12)27-18)10-11-15(24)19-21(26)23-13-7-3-5-9-17(13)28-19/h2-11,18-19H,1H3,(H,22,25)(H,23,26)
InChIKey	YVYPZZKMPZYZJS-UHFFFAOYSA-N
Molecular Weight	407.506 g/mol
SMILES	N1c2c(SC(c3[n](c(C4C(Nc5c(S4)cccc5)=O)cc3)C)C1=O)cccc2
SPLASH	splash10-0a4i-1040900000-0918db74cdef48e5a995
Source of Spectrum	CV-2004-1199-17
Synonyms	2-[1-methyl-5-(3-oxo-4H-1,4-benzothiazin-2-yl)-2-pyrrolyl]-4H-1,4-benzothiazin-3-one 2-[1-methyl-5-(3-oxo-4H-1,4-benzothiazin-2-yl)pyrrol-2-yl]-4H-1,4-benzothiazin-3-one 2-[5-(3-keto-4H-1,4-benzothiazin-2-yl)-1-methyl-pyrrol-2-yl]-4H-1,4-benzothiazin-3-one
Wiley ID	1611373