2-azanyl-4-(4-bromanylthiophen-2-yl)-5-oxidanylidene-1-phenyl-4,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-azanyl-4-(4-bromanylthiophen-2-yl)-5-oxidanylidene-1-phenyl-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-(4-bromo-2-thienyl)-5-oxo-1-phenyl-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-(4-bromo-2-thiophenyl)-5-oxo-1-phenyl-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-(4-bromothiophen-2-yl)-5-oxo-1-phenyl-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-4-(4-bromo-2-thienyl)-5-keto-1-phenyl-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C20H16BrN3OS MolecularWeight: 426.32954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(C(=C(N2C3=CC=CC=C3)N)C#N)C4=CC(=CS4)Br)C(=O)C1

Isomeric SMILES

C1CC2=C(C(C(=C(N2C3=CC=CC=C3)N)C#N)C4=CC(=CS4)Br)C(=O)C1

InChI

InChI=1S/C20H16BrN3OS/c21-12-9-17(26-11-12)18-14(10-22)20(23)24(13-5-2-1-3-6-13)15-7-4-8-16(25)19(15)18/h1-3,5-6,9,11,18H,4,7-8,23H2