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N-(4-Amino-5-cyano-6-sulfanyl-3-phenyl-2H-thiopyran-2-ylidene)-benzenesulfonamide
SpectraBase Compound ID J8Bkwge1Mu5
InChI InChI=1S/C18H13N3O2S3/c19-11-14-16(20)15(12-7-3-1-4-8-12)17(25-18(14)24)21-26(22,23)13-9-5-2-6-10-13/h1-10,24H,20H2
InChIKey IWXGNSMWUZYAIP-UHFFFAOYSA-N
Mol Weight 399.5 g/mol
Molecular Formula C18H13N3O2S3
Exact Mass 399.01699 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8jOhcqP07TE
Name N-(4-Amino-5-cyano-6-sulfanyl-3-phenyl-2H-thiopyran-2-ylidene)-benzenesulfonamide
Alternate Name(s) N-(4-amino-5-cyano-6-mercapto-3-phenyl-2H-thiopyran-2-ylidene)benzenesulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H13N3O2S3
InChI InChI=1S/C18H13N3O2S3/c19-11-14-16(20)15(12-7-3-1-4-8-12)17(25-18(14)24)21-26(22,23)13-9-5-2-6-10-13/h1-10,24H,20H2
InChIKey IWXGNSMWUZYAIP-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.201200600
Molecular Weight 399.501 g/mol
SMILES NC1=C(C(SC(=C1C#N)S)=NS(=O)(=O)c1ccccc1)c1ccccc1
SPLASH splash10-002f-3911000000-8a0873149c17c8512808
Source of Spectrum H-96-2144-5b
Wiley ID 1784603