2-azanyl-1-(4-bromanyl-2-fluoranyl-phenyl)-4-(4-bromanyl-5-methyl-thiophen-2-yl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-azanyl-1-(4-bromanyl-2-fluoranyl-phenyl)-4-(4-bromanyl-5-methyl-thiophen-2-yl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-1-(4-bromo-2-fluoro-phenyl)-4-(4-bromo-5-methyl-2-thienyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-1-(4-bromo-2-fluorophenyl)-4-(4-bromo-5-methyl-2-thiophenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-1-(4-bromo-2-fluorophenyl)-4-(4-bromo-5-methylthiophen-2-yl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-1-(4-bromo-2-fluoro-phenyl)-4-(4-bromo-5-methyl-2-thienyl)-5-keto-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C21H16Br2FN3OS MolecularWeight: 537.242643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(S1)C2C(=C(N(C3=C2C(=O)CCC3)C4=C(C=C(C=C4)Br)F)N)C#N)Br

Isomeric SMILES

CC1=C(C=C(S1)C2C(=C(N(C3=C2C(=O)CCC3)C4=C(C=C(C=C4)Br)F)N)C#N)Br

InChI

InChI=1S/C21H16Br2FN3OS/c1-10-13(23)8-18(29-10)19-12(9-25)21(26)27(15-6-5-11(22)7-14(15)24)16-3-2-4-17(28)20(16)19/h5-8,19H,2-4,26H2,1H3