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benzo[b]thiophene-3-carboxylic acid, 2-[[[(3,4-dichlorophenyl)amino]carbonyl]amino]-4,5,6,7-tetrahydro-, methyl ester
SpectraBase Compound ID 6yoNjmSNVIu
InChI InChI=1S/C17H16Cl2N2O3S/c1-24-16(22)14-10-4-2-3-5-13(10)25-15(14)21-17(23)20-9-6-7-11(18)12(19)8-9/h6-8H,2-5H2,1H3,(H2,20,21,23)
InChIKey QIDKETOIHQJRKY-UHFFFAOYSA-N
Mol Weight 399.29 g/mol
Molecular Formula C17H16Cl2N2O3S
Exact Mass 398.025869 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6EGrsWqCXyw
Name 2-[(3,4-dichlorophenyl)carbamoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid methyl ester
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Formula C17H16Cl2N2O3S
InChI InChI=1S/C17H16Cl2N2O3S/c1-24-16(22)14-10-4-2-3-5-13(10)25-15(14)21-17(23)20-9-6-7-11(18)12(19)8-9/h6-8H,2-5H2,1H3,(H2,20,21,23)
InChIKey QIDKETOIHQJRKY-UHFFFAOYSA-N
Molecular Weight 399.292 g/mol
SMILES N(c1c(c2CCCCc2s1)C(=O)OC)C(Nc1cc(Cl)c(cc1)Cl)=O
SPLASH splash10-01t9-4940000000-89979630f9f28aa8629d
Synonyms 2-[[(3,4-dichloroanilino)-oxomethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid methyl ester Methyl 2-[(3,4-dichlorophenyl)carbamoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Methyl 2-[(3,4-dichlorophenyl)carbamoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate
Wiley ID 1454455