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5-Acetyl-4-methyl-2-[(3-morpholinosulfonylbenzoyl)amino]thiophene-3-carboxylic acid ethyl ester
SpectraBase Compound ID F8gzi2athKx
InChI InChI=1S/C21H24N2O7S2/c1-4-30-21(26)17-13(2)18(14(3)24)31-20(17)22-19(25)15-6-5-7-16(12-15)32(27,28)23-8-10-29-11-9-23/h5-7,12H,4,8-11H2,1-3H3,(H,22,25)
InChIKey PTBUZXPLOKMVIB-UHFFFAOYSA-N
Mol Weight 480.55 g/mol
Molecular Formula C21H24N2O7S2
Exact Mass 480.102493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EeW556CCJqV
Name 5-Acetyl-4-methyl-2-[(3-morpholinosulfonylbenzoyl)amino]thiophene-3-carboxylic acid ethyl ester
Alternate Name(s) 5-Acetyl-4-methyl-2-[[[3-(4-morpholinylsulfonyl)phenyl]-oxomethyl]amino]-3-thiophenecarboxylic acid ethyl ester Ethyl 5-acetyl-4-methyl-2-[(3-morpholin-4-ylsulfonylbenzoyl)amino]thiophene-3-carboxylate Ethyl 5-acetyl-4-methyl-2-[(3-morpholinosulfonylbenzoyl)amino]thiophene-3-carboxylate Ethyl 5-ethanoyl-4-methyl-2-[(3-morpholin-4-ylsulfonylphenyl)carbonylamino]thiophene-3-carboxylate
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Formula C21H24N2O7S2
InChI InChI=1S/C21H24N2O7S2/c1-4-30-21(26)17-13(2)18(14(3)24)31-20(17)22-19(25)15-6-5-7-16(12-15)32(27,28)23-8-10-29-11-9-23/h5-7,12H,4,8-11H2,1-3H3,(H,22,25)
InChIKey PTBUZXPLOKMVIB-UHFFFAOYSA-N
Molecular Weight 480.550 g/mol
SMILES N(c1c(c(C)c(s1)C(=O)C)C(=O)OCC)C(c1cc(S(N2CCOCC2)(=O)=O)ccc1)=O
SPLASH splash10-0zgi-9740400000-e311cb23836092720195
Wiley ID 1461418