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N-(5-(5-Amino-4-cyano-3-(p-tolyl)-2,3-dihydrothiophene-2-carbonyl)-4-methylthiazol-2-yl)-4-methylbenzenesulfonamide
SpectraBase Compound ID 64Z2rydqB2B
InChI InChI=1S/C24H22N4O3S3/c1-13-4-8-16(9-5-13)19-18(12-25)23(26)32-22(19)20(29)21-15(3)27-24(33-21)28-34(30,31)17-10-6-14(2)7-11-17/h4-11,19,22H,26H2,1-3H3,(H,27,28)
InChIKey RBEXVCKQYYHVTL-UHFFFAOYSA-N
Mol Weight 510.65 g/mol
Molecular Formula C24H22N4O3S3
Exact Mass 510.085404 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5H9XhH3KOkA
Name N-(5-(5-Amino-4-cyano-3-(p-tolyl)-2,3-dihydrothiophene-2-carbonyl)-4-methylthiazol-2-yl)-4-methylbenzenesulfonamide
Appearance Brown crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H22N4O3S3
InChI InChI=1S/C24H22N4O3S3/c1-13-4-8-16(9-5-13)19-18(12-25)23(26)32-22(19)20(29)21-15(3)27-24(33-21)28-34(30,31)17-10-6-14(2)7-11-17/h4-11,19,22H,26H2,1-3H3,(H,27,28)
InChIKey RBEXVCKQYYHVTL-UHFFFAOYSA-N
Instrument Name VG Autospec
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3995
Molecular Weight 510.645 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)c1nc(c(C(C2C(C(=C(S2)N)C#N)c2ccc(cc2)C)=O)s1)C
SPLASH splash10-08fr-6983540000-6ac89db2a613fee80d51
Source of Spectrum Y-57-2870-6b
Wiley ID 1860262