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3-Amino-6-nitro-N-phenyl-4-(phenylthio)-1-benzothiophene-2-carboxamide
SpectraBase Compound ID 3ZfoCjv9S6G
InChI InChI=1S/C21H15N3O3S2/c22-19-18-16(28-15-9-5-2-6-10-15)11-14(24(26)27)12-17(18)29-20(19)21(25)23-13-7-3-1-4-8-13/h1-12H,22H2,(H,23,25)
InChIKey OUPVCLMTQABPOU-UHFFFAOYSA-N
Mol Weight 421.49 g/mol
Molecular Formula C21H15N3O3S2
Exact Mass 421.055484 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Dzu1Bn8zQf
Name 3-Amino-6-nitro-N-phenyl-4-(phenylthio)-1-benzothiophene-2-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H15N3O3S2
InChI InChI=1S/C21H15N3O3S2/c22-19-18-16(28-15-9-5-2-6-10-15)11-14(24(26)27)12-17(18)29-20(19)21(25)23-13-7-3-1-4-8-13/h1-12H,22H2,(H,23,25)
InChIKey OUPVCLMTQABPOU-UHFFFAOYSA-N
Molecular Weight 421.489 g/mol
SMILES Nc1c(C(Nc2ccccc2)=O)sc2cc(cc(c12)Sc1ccccc1)N(=O)=O
SPLASH splash10-0096-9533100000-0c428e3eaa574f6bd50f
Synonyms 3-Amino-6-nitro-N-phenyl-4-(phenylthio)benzothiophene-2-carboxamide 3-Amino-6-nitro-N-phenyl-4-phenylsulfanyl-1-benzothiophene-2-carboxamide 3-Amino-6-nitro-N-phenyl-4-phenylsulfanyl-benzothiophene-2-carboxamide 3-Azanyl-6-nitro-N-phenyl-4-phenylsulfanyl-1-benzothiophene-2-carboxamide
Wiley ID 1462832