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1-(2-Chlorophenyl)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-oxidanylidene-pyrrolidine-3-carboxamide
SpectraBase Compound ID IbUY2Vwzmi3
InChI InChI=1S/C20H18ClN3O2S/c21-15-6-2-3-7-16(15)24-11-12(9-18(24)25)19(26)23-20-14(10-22)13-5-1-4-8-17(13)27-20/h2-3,6-7,12H,1,4-5,8-9,11H2,(H,23,26)
InChIKey JFOMBCSQEQDAQJ-UHFFFAOYSA-N
Mol Weight 399.9 g/mol
Molecular Formula C20H18ClN3O2S
Exact Mass 399.080826 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7tT5z8ncwPM
Name 1-(2-Chlorophenyl)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-oxidanylidene-pyrrolidine-3-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H18ClN3O2S
InChI InChI=1S/C20H18ClN3O2S/c21-15-6-2-3-7-16(15)24-11-12(9-18(24)25)19(26)23-20-14(10-22)13-5-1-4-8-17(13)27-20/h2-3,6-7,12H,1,4-5,8-9,11H2,(H,23,26)
InChIKey JFOMBCSQEQDAQJ-UHFFFAOYSA-N
Molecular Weight 399.896 g/mol
SMILES N(c1c(c2CCCCc2s1)C#N)C(C1CN(c2c(Cl)cccc2)C(C1)=O)=O
SPLASH splash10-002f-1900000000-9e16bfb0813fb1200db6
Synonyms 1-(2-Chlorophenyl)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-oxo-3-pyrrolidinecarboxamide 1-(2-Chlorophenyl)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-oxopyrrolidine-3-carboxamide 1-(2-Chlorophenyl)-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-5-keto-pyrrolidine-3-carboxamide 1-(2-Chlorophenyl)-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-5-oxo-pyrrolidine-3-carboxamide
Wiley ID 1454858