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2-amino-5-[(5-amino-4-carbomethoxy-3-isobutyl-2-thienyl)disulfanyl]-4-isobutyl-thiophene-3-carboxylic acid methyl ester
SpectraBase Compound ID JESpvVbygRZ
InChI InChI=1S/C20H28N2O4S4/c1-9(2)7-11-13(17(23)25-5)15(21)27-19(11)29-30-20-12(8-10(3)4)14(16(22)28-20)18(24)26-6/h9-10H,7-8,21-22H2,1-6H3
InChIKey KQBCDRBKZYFAJT-UHFFFAOYSA-N
Mol Weight 488.7 g/mol
Molecular Formula C20H28N2O4S4
Exact Mass 488.093192 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3ly6wM1qZti
Name 2-amino-5-[(5-amino-4-carbomethoxy-3-isobutyl-2-thienyl)disulfanyl]-4-isobutyl-thiophene-3-carboxylic acid methyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C20H28N2O4S4
InChI InChI=1S/C20H28N2O4S4/c1-9(2)7-11-13(17(23)25-5)15(21)27-19(11)29-30-20-12(8-10(3)4)14(16(22)28-20)18(24)26-6/h9-10H,7-8,21-22H2,1-6H3
InChIKey KQBCDRBKZYFAJT-UHFFFAOYSA-N
Molecular Weight 488.694 g/mol
SMILES Nc1c(c(c(SSc2c(c(c(s2)N)C(=O)OC)CC(C)C)s1)CC(C)C)C(=O)OC
SPLASH splash10-0002-0090000000-9d90a36bdf2513ed8c97
Source of Spectrum AH-127-301-5
Synonyms 2-amino-5-[[5-amino-4-methoxycarbonyl-3-(2-methylpropyl)-2-thiophenyl]disulfanyl]-4-(2-methylpropyl)-3-thiophenecarboxylic acid methyl ester methyl 2-amino-5-[(5-amino-3-isobutyl-4-methoxycarbonyl-2-thienyl)disulfanyl]-4-isobutyl-thiophene-3-carboxylate methyl 2-amino-5-[[5-amino-4-methoxycarbonyl-3-(2-methylpropyl)thiophen-2-yl]disulfanyl]-4-(2-methylpropyl)thiophene-3-carboxylate methyl 2-azanyl-5-[[5-azanyl-4-methoxycarbonyl-3-(2-methylpropyl)thiophen-2-yl]disulfanyl]-4-(2-methylpropyl)thiophene-3-carboxylate
Wiley ID 1396795