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3-amino-N'-[1-(4-(piperidin-1-ylsulfonyl)phenyl)ethylidene]-4,5,6,7-tetrahydrobenzo[b]-thiophene-2-carbohydrazide
SpectraBase Compound ID 2yYnYsysC1E
InChI InChI=1S/C22H28N4O3S2/c1-15(24-25-22(27)21-20(23)18-7-3-4-8-19(18)30-21)16-9-11-17(12-10-16)31(28,29)26-13-5-2-6-14-26/h9-12H,2-8,13-14,23H2,1H3,(H,25,27)/b24-15+
InChIKey CWGDIILFWVBVKK-BUVRLJJBSA-N
Mol Weight 460.61 g/mol
Molecular Formula C22H28N4O3S2
Exact Mass 460.160283 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6iSRrupvROq
Name 3-amino-N'-[1-(4-(piperidin-1-ylsulfonyl)phenyl)ethylidene]-4,5,6,7-tetrahydrobenzo[b]-thiophene-2-carbohydrazide
Alternate Name(s) 3-amino-N-[(E)-1-[4-(1-piperidinylsulfonyl)phenyl]ethylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide 3-amino-N-[(E)-1-(4-piperidin-1-ylsulfonylphenyl)ethylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide 3-amino-N-[(E)-1-[4-(1-piperidylsulfonyl)phenyl]ethylideneamino]-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide 3-azanyl-N-[(E)-1-(4-piperidin-1-ylsulfonylphenyl)ethylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide
Comments Less than 3 mono-isotopic peaks
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Formula C22H28N4O3S2
InChI InChI=1S/C22H28N4O3S2/c1-15(24-25-22(27)21-20(23)18-7-3-4-8-19(18)30-21)16-9-11-17(12-10-16)31(28,29)26-13-5-2-6-14-26/h9-12H,2-8,13-14,23H2,1H3,(H,25,27)/b24-15+
InChIKey CWGDIILFWVBVKK-BUVRLJJBSA-N
Molecular Weight 460.611 g/mol
SMILES Nc1c2CCCCc2sc1C(N\N=C\(c1ccc(S(N2CCCCC2)(=O)=O)cc1)C)=O
SPLASH splash10-001i-9000000000-045633fa17365203c271
Source of Spectrum F2-46-140-21
Wiley ID 1690181