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

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anti-2-[2-{1-(2-Methyl-4,5-diphenyl-1H-pyrrol-3-yl)ethylidene}hydrazino]-4-amino-6-(4-chlorophenyl)-6H-1,3-thiazine-5-carbonitrile
SpectraBase Compound ID DzVpGcQpdNU
InChI InChI=1S/C30H25ClN6S/c1-18-25(26(20-9-5-3-6-10-20)27(34-18)21-11-7-4-8-12-21)19(2)36-37-30-35-29(33)24(17-32)28(38-30)22-13-15-23(31)16-14-22/h3-16,28,34H,33H2,1-2H3,(H,35,37)/b36-19+
InChIKey KZGNXLLNVKVUJZ-ODNPBWNPSA-N
Mol Weight 537.09 g/mol
Molecular Formula C30H25ClN6S
Exact Mass 536.154994 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 33Vr6gixBg
Name anti-2-[2-{1-(2-Methyl-4,5-diphenyl-1H-pyrrol-3-yl)ethylidene}hydrazino]-4-amino-6-(4-chlorophenyl)-6H-1,3-thiazine-5-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H25ClN6S
InChI InChI=1S/C30H25ClN6S/c1-18-25(26(20-9-5-3-6-10-20)27(34-18)21-11-7-4-8-12-21)19(2)36-37-30-35-29(33)24(17-32)28(38-30)22-13-15-23(31)16-14-22/h3-16,28,34H,33H2,1-2H3,(H,35,37)/b36-19+
InChIKey KZGNXLLNVKVUJZ-ODNPBWNPSA-N
Literature Reference DOI 10.3987/COM-15-13210
Molecular Weight 537.085 g/mol
SMILES NC=1N=C(SC(C1C#N)c1ccc(cc1)Cl)N\N=C\(c1c([nH]c(c1-c1ccccc1)-c1ccccc1)C)C
SPLASH splash10-000i-2305090000-ac8447963c2ba4994483
Source of Spectrum H1-91-1239-9b
Synonyms (E)-4-amino-6-(4-chlorophenyl)-2-(2-(1-(2-methyl-4,5-diphenyl-1H-pyrrol-3-yl)ethylidene)hydrazineyl)-6H-1,3-thiazine-5-carbonitrile
Wiley ID 1804069