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2-Amino-1-(2-chloro-4-nitro-phenyl)-5-keto-4-(3-thienyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile
SpectraBase Compound ID ITjo69OJ7GK
InChI InChI=1S/C20H15ClN4O3S/c21-14-8-12(25(27)28)4-5-15(14)24-16-2-1-3-17(26)19(16)18(11-6-7-29-10-11)13(9-22)20(24)23/h4-8,10,18H,1-3,23H2
InChIKey YQERRPXATONXBC-UHFFFAOYSA-N
Mol Weight 426.88 g/mol
Molecular Formula C20H15ClN4O3S
Exact Mass 426.055339 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kv1j0dgJL96
Name 2-Amino-1-(2-chloro-4-nitro-phenyl)-5-keto-4-(3-thienyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile
Alternate Name(s) 2-Amino-1-(2-chloro-4-nitro-phenyl)-5-oxo-4-(3-thienyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile 2-Amino-1-(2-chloro-4-nitrophenyl)-5-oxo-4-(3-thiophenyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile 2-Amino-1-(2-chloro-4-nitrophenyl)-5-oxo-4-thiophen-3-yl-4,6,7,8-tetrahydroquinoline-3-carbonitrile 2-Azanyl-1-(2-chloranyl-4-nitro-phenyl)-5-oxidanylidene-4-thiophen-3-yl-4,6,7,8-tetrahydroquinoline-3-carbonitrile
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Formula C20H15ClN4O3S
InChI InChI=1S/C20H15ClN4O3S/c21-14-8-12(25(27)28)4-5-15(14)24-16-2-1-3-17(26)19(16)18(11-6-7-29-10-11)13(9-22)20(24)23/h4-8,10,18H,1-3,23H2
InChIKey YQERRPXATONXBC-UHFFFAOYSA-N
Molecular Weight 426.878 g/mol
SMILES NC=1N(c2c(cc(N(=O)=O)cc2)Cl)C2=C(C(C1C#N)c1cscc1)C(=O)CCC2
SPLASH splash10-014r-9510000000-b666641064a95bf47862
Wiley ID 1448158