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4-(2-Amino-4-(4-chlorophenyl)-3-cyano-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinolin-1(4H)-yl)benzenesulfonamide
SpectraBase Compound ID CnmkSKztlik
InChI InChI=1S/C24H23ClN4O3S/c1-24(2)11-19-22(20(30)12-24)21(14-3-5-15(25)6-4-14)18(13-26)23(27)29(19)16-7-9-17(10-8-16)33(28,31)32/h3-10,21H,11-12,27H2,1-2H3,(H2,28,31,32)
InChIKey ZBRKFELTANBJQS-UHFFFAOYSA-N
Mol Weight 482.99 g/mol
Molecular Formula C24H23ClN4O3S
Exact Mass 482.117939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID yX5J7M5pfW
Name 4-(2-Amino-4-(4-chlorophenyl)-3-cyano-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinolin-1(4H)-yl)benzenesulfonamide
Alternate Name(s) 4-[2-amino-4-(4-chlorophenyl)-3-cyano-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinolin-1-yl]benzenesulfonamide 4-[2-azanyl-4-(4-chlorophenyl)-3-cyano-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-quinolin-1-yl]benzenesulfonamide
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H23ClN4O3S
InChI InChI=1S/C24H23ClN4O3S/c1-24(2)11-19-22(20(30)12-24)21(14-3-5-15(25)6-4-14)18(13-26)23(27)29(19)16-7-9-17(10-8-16)33(28,31)32/h3-10,21H,11-12,27H2,1-2H3,(H2,28,31,32)
InChIKey ZBRKFELTANBJQS-UHFFFAOYSA-N
Molecular Weight 482.986 g/mol
SMILES NS(c1ccc(N2C3=C(C(C(=C2N)C#N)c2ccc(cc2)Cl)C(CC(C3)(C)C)=O)cc1)(=O)=O
SPLASH splash10-00di-0009400000-213b086bd1a3fb721375
Source of Spectrum F2-45-3681-6
Wiley ID 1703357