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5-Carbamoyl-2-(4-iodo-benzoylamino)-4-methyl-thiophene-3-carboxylic acid methyl ester
SpectraBase Compound ID JCareiHqbWT
InChI InChI=1S/C15H13IN2O4S/c1-7-10(15(21)22-2)14(23-11(7)12(17)19)18-13(20)8-3-5-9(16)6-4-8/h3-6H,1-2H3,(H2,17,19)(H,18,20)
InChIKey HKQWLMPNHQXNQV-UHFFFAOYSA-N
Mol Weight 444.24 g/mol
Molecular Formula C15H13IN2O4S
Exact Mass 443.964073 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8I2YOZppO9a
Name 5-Carbamoyl-2-(4-iodo-benzoylamino)-4-methyl-thiophene-3-carboxylic acid methyl ester
Alternate Name(s) Methyl 5-(aminocarbonyl)-2-[(4-iodobenzoyl)amino]-4-methyl-3-thiophenecarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H13IN2O4S
InChI InChI=1S/C15H13IN2O4S/c1-7-10(15(21)22-2)14(23-11(7)12(17)19)18-13(20)8-3-5-9(16)6-4-8/h3-6H,1-2H3,(H2,17,19)(H,18,20)
InChIKey HKQWLMPNHQXNQV-UHFFFAOYSA-N
Molecular Weight 444.243 g/mol
SMILES NC(c1c(c(c(s1)NC(=O)c1ccc(cc1)I)C(OC)=O)C)=O
SPLASH splash10-0fai-9370000000-8ba1823362789927aef3
Wiley ID 1463712