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N-(3-cyano-4,5,6,7-tetrahydro-1-benzothien-2-yl)-3-({3-[(3-cyano-4,5,6,7-tetrahydro-1-benzothien-2-yl)amino]-3-oxopropyl}sulfanyl)propanamide
SpectraBase Compound ID HjNfoABU4oO
InChI InChI=1S/C24H26N4O2S3/c25-13-17-15-5-1-3-7-19(15)32-23(17)27-21(29)9-11-31-12-10-22(30)28-24-18(14-26)16-6-2-4-8-20(16)33-24/h1-12H2,(H,27,29)(H,28,30)
InChIKey AWKMAOUVPXEBOA-UHFFFAOYSA-N
Mol Weight 498.68 g/mol
Molecular Formula C24H26N4O2S3
Exact Mass 498.12179 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8lvFDysR6os
Name N-(3-cyano-4,5,6,7-tetrahydro-1-benzothien-2-yl)-3-({3-[(3-cyano-4,5,6,7-tetrahydro-1-benzothien-2-yl)amino]-3-oxopropyl}sulfanyl)propanamide
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Formula C24H26N4O2S3
InChI InChI=1S/C24H26N4O2S3/c25-13-17-15-5-1-3-7-19(15)32-23(17)27-21(29)9-11-31-12-10-22(30)28-24-18(14-26)16-6-2-4-8-20(16)33-24/h1-12H2,(H,27,29)(H,28,30)
InChIKey AWKMAOUVPXEBOA-UHFFFAOYSA-N
Molecular Weight 498.678 g/mol
SMILES N(c1c(c2CCCCc2s1)C#N)C(CCSCCC(Nc1c(c2c(s1)CCCC2)C#N)=O)=O
SPLASH splash10-004i-4910000000-dda2c7f32df02ad8c17a
Synonyms N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-[3-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-3-oxidanylidene-propyl]sulfanyl-propanamide N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-[3-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-3-oxopropyl]sulfanylpropanamide N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-[[3-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-3-oxopropyl]thio]propanamide N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3-[3-[(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]-3-oxo-propyl]sulfanyl-propanamide N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3-[[3-[(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]-3-keto-propyl]thio]propionamide
Wiley ID 1446356