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3-Amino-4-(4-chlorophenyl)-N-(4-methoxyphenyl)-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridine-2-carboxamide
SpectraBase Compound ID 52M9joQepiY
InChI InChI=1S/C24H20ClN3O2S/c1-30-16-11-9-15(10-12-16)27-23(29)22-21(26)20-19(13-5-7-14(25)8-6-13)17-3-2-4-18(17)28-24(20)31-22/h5-12H,2-4,26H2,1H3,(H,27,29)
InChIKey BUFUCPKEMGOFNP-UHFFFAOYSA-N
Mol Weight 449.96 g/mol
Molecular Formula C24H20ClN3O2S
Exact Mass 449.096476 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1TxNflli3pM
Name 3-Amino-4-(4-chlorophenyl)-N-(4-methoxyphenyl)-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridine-2-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H20ClN3O2S
InChI InChI=1S/C24H20ClN3O2S/c1-30-16-11-9-15(10-12-16)27-23(29)22-21(26)20-19(13-5-7-14(25)8-6-13)17-3-2-4-18(17)28-24(20)31-22/h5-12H,2-4,26H2,1H3,(H,27,29)
InChIKey BUFUCPKEMGOFNP-UHFFFAOYSA-N
Molecular Weight 449.956 g/mol
SMILES Nc1c(C(Nc2ccc(cc2)OC)=O)sc2nc3CCCc3c(c12)-c1ccc(cc1)Cl
SPLASH splash10-0200-0987100000-6d837c9b096b2b52f0b0
Wiley ID 1453715