5-azanyl-3-(4-bromanyl-3-fluoranyl-phenyl)-2-(phenylcarbonyl)-2,3-dihydrothiophene-4-carbonitrile

Systemtic Name: 5-azanyl-3-(4-bromanyl-3-fluoranyl-phenyl)-2-(phenylcarbonyl)-2,3-dihydrothiophene-4-carbonitrile Openeye Name: 5-amino-2-benzoyl-3-(4-bromo-3-fluoro-phenyl)-2,3-dihydrothiophene-4-carbonitrile CAS Name: 5-amino-2-benzoyl-3-(4-bromo-3-fluorophenyl)-2,3-dihydrothiophene-4-carbonitrile IUPAC Name: 5-amino-2-benzoyl-3-(4-bromo-3-fluorophenyl)-2,3-dihydrothiophene-4-carbonitrile Traditional Name: 5-amino-2-benzoyl-3-(4-bromo-3-fluoro-phenyl)-2,3-dihydrothiophene-4-carbonitrile Formula: C18H12BrFN2OS MolecularWeight: 403.268083

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2C(C(=C(S2)N)C#N)C3=CC(=C(C=C3)Br)F

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2C(C(=C(S2)N)C#N)C3=CC(=C(C=C3)Br)F

InChI

InChI=1S/C18H12BrFN2OS/c19-13-7-6-11(8-14(13)20)15-12(9-21)18(22)24-17(15)16(23)10-4-2-1-3-5-10/h1-8,15,17H,22H2