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4-Amino-2-anilino-5-(4-bromobenzoyl)-3-thiophenecarbonitrile

View entire compound with spectra: 1 MS (GC)

4-Amino-2-anilino-5-(4-bromobenzoyl)-3-thiophenecarbonitrile
SpectraBase Compound ID FVXLvrQiDlB
InChI InChI=1S/C18H12BrN3OS/c19-12-8-6-11(7-9-12)16(23)17-15(21)14(10-20)18(24-17)22-13-4-2-1-3-5-13/h1-9,22H,21H2
InChIKey MPUVLRPFSUICQS-UHFFFAOYSA-N
Mol Weight 398.28 g/mol
Molecular Formula C18H12BrN3OS
Exact Mass 396.988446 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GkD7uXG2LmI
Name 4-Amino-2-anilino-5-(4-bromobenzoyl)-3-thiophenecarbonitrile
Alternate Name(s) 4-Amino-2-anilino-5-(4-bromobenzoyl)thiophene-3-carbonitrile 4-Amino-2-anilino-5-[(4-bromophenyl)-oxomethyl]-3-thiophenecarbonitrile 4-Azanyl-5-(4-bromophenyl)carbonyl-2-phenylazanyl-thiophene-3-carbonitrile
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Formula C18H12BrN3OS
InChI InChI=1S/C18H12BrN3OS/c19-12-8-6-11(7-9-12)16(23)17-15(21)14(10-20)18(24-17)22-13-4-2-1-3-5-13/h1-9,22H,21H2
InChIKey MPUVLRPFSUICQS-UHFFFAOYSA-N
Molecular Weight 398.278 g/mol
SMILES N(c1c(c(c(s1)C(c1ccc(cc1)Br)=O)N)C#N)c1ccccc1
SPLASH splash10-0a4i-9621000000-dcfc5a8ae4d582011c8c
Wiley ID 1451521