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anti-2-[2-{1-(2-Methyl-4,5-diphenyl-1H-pyrrol-3-yl)ethylidene}hydrazino]-4-amino-6-(4-methoxyphenyl)-6H-1,3-thiazine-5-carbonitrile

View entire compound with spectra: 1 MS (GC)

anti-2-[2-{1-(2-Methyl-4,5-diphenyl-1H-pyrrol-3-yl)ethylidene}hydrazino]-4-amino-6-(4-methoxyphenyl)-6H-1,3-thiazine-5-carbonitrile
SpectraBase Compound ID 3lZb0B4VXMO
InChI InChI=1S/C31H28N6OS/c1-19-26(27(21-10-6-4-7-11-21)28(34-19)22-12-8-5-9-13-22)20(2)36-37-31-35-30(33)25(18-32)29(39-31)23-14-16-24(38-3)17-15-23/h4-17,29,34H,33H2,1-3H3,(H,35,37)/b36-20+
InChIKey BNBIEYDEYFOOSZ-ZSNJKBEMSA-N
Mol Weight 532.67 g/mol
Molecular Formula C31H28N6OS
Exact Mass 532.204531 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H8USmUDlFjx
Name anti-2-[2-{1-(2-Methyl-4,5-diphenyl-1H-pyrrol-3-yl)ethylidene}hydrazino]-4-amino-6-(4-methoxyphenyl)-6H-1,3-thiazine-5-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H28N6OS
InChI InChI=1S/C31H28N6OS/c1-19-26(27(21-10-6-4-7-11-21)28(34-19)22-12-8-5-9-13-22)20(2)36-37-31-35-30(33)25(18-32)29(39-31)23-14-16-24(38-3)17-15-23/h4-17,29,34H,33H2,1-3H3,(H,35,37)/b36-20+
InChIKey BNBIEYDEYFOOSZ-ZSNJKBEMSA-N
Literature Reference DOI 10.3987/COM-15-13210
Molecular Weight 532.666 g/mol
SMILES NC=1N=C(SC(C1C#N)c1ccc(cc1)OC)N\N=C\(c1c([nH]c(c1-c1ccccc1)-c1ccccc1)C)C
SPLASH splash10-004r-9405040000-26de1f016bbcd3fe089b
Source of Spectrum H1-91-1239-9d
Synonyms (E)-4-amino-6-(4-methoxyphenyl)-2-(2-(1-(2-methyl-4,5-diphenyl-1H-pyrrol-3-yl)ethylidene)hydrazineyl)-6H-1,3-thiazine-5-carbonitrile
Wiley ID 1804071