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Butyric acid, 2-acetylamino-4-methylsulfanyl-, (5-isopropyl-[1,3,4]thiadiazol-2-ylcarbamoyl)methyl ester
SpectraBase Compound ID 5u0kaIgjTnq
InChI InChI=1S/C14H22N4O4S2/c1-8(2)12-17-18-14(24-12)16-11(20)7-22-13(21)10(5-6-23-4)15-9(3)19/h8,10H,5-7H2,1-4H3,(H,15,19)(H,16,18,20)
InChIKey LGTNJPLXJSZZER-UHFFFAOYSA-N
Mol Weight 374.47 g/mol
Molecular Formula C14H22N4O4S2
Exact Mass 374.108248 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FXvTqHHfU6O
Name Butyric acid, 2-acetylamino-4-methylsulfanyl-, (5-isopropyl-[1,3,4]thiadiazol-2-ylcarbamoyl)methyl ester
Alternate Name(s) 2-Acetamido-4-(methylthio)butanoic acid [2-oxo-2-[(5-propan-2-yl-1,3,4-thiadiazol-2-yl)amino]ethyl] ester [2-oxo-2-[(5-propan-2-yl-1,3,4-thiadiazol-2-yl)amino]ethyl] 2-acetamido-4-methylsulfanylbutanoate [2-[(5-isopropyl-1,3,4-thiadiazol-2-yl)amino]-2-oxo-ethyl] 2-acetamido-4-methylsulfanyl-butanoate [2-oxidanylidene-2-[(5-propan-2-yl-1,3,4-thiadiazol-2-yl)amino]ethyl] 2-acetamido-4-methylsulfanyl-butanoate
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Formula C14H22N4O4S2
InChI InChI=1S/C14H22N4O4S2/c1-8(2)12-17-18-14(24-12)16-11(20)7-22-13(21)10(5-6-23-4)15-9(3)19/h8,10H,5-7H2,1-4H3,(H,15,19)(H,16,18,20)
InChIKey LGTNJPLXJSZZER-UHFFFAOYSA-N
Molecular Weight 374.474 g/mol
SMILES N(c1sc(nn1)C(C)C)C(COC(C(NC(=O)C)CCSC)=O)=O
SPLASH splash10-0udl-9633000000-ce77c370f9ef670b2a2b
Wiley ID 1436652