5-azanyl-6-(4-bromophenyl)-2-[(4-fluorophenyl)amino]-4-oxidanylidene-thiopyran-3-carbonitrile

Systemtic Name: 5-azanyl-6-(4-bromophenyl)-2-[(4-fluorophenyl)amino]-4-oxidanylidene-thiopyran-3-carbonitrile Openeye Name: 5-amino-6-(4-bromophenyl)-2-(4-fluoroanilino)-4-oxo-thiopyran-3-carbonitrile CAS Name: 5-amino-6-(4-bromophenyl)-2-(4-fluoroanilino)-4-oxo-3-thiopyrancarbonitrile IUPAC Name: 5-amino-6-(4-bromophenyl)-2-(4-fluoroanilino)-4-oxothiopyran-3-carbonitrile Traditional Name: 5-amino-6-(4-bromophenyl)-2-(4-fluoroanilino)-4-keto-thiopyran-3-carbonitrile Formula: C18H11BrFN3OS MolecularWeight: 416.266843

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C(C(=O)C(=C(S2)NC3=CC=C(C=C3)F)C#N)N)Br

Isomeric SMILES

C1=CC(=CC=C1C2=C(C(=O)C(=C(S2)NC3=CC=C(C=C3)F)C#N)N)Br

InChI

InChI=1S/C18H11BrFN3OS/c19-11-3-1-10(2-4-11)17-15(22)16(24)14(9-21)18(25-17)23-13-7-5-12(20)6-8-13/h1-8,23H,22H2