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

Systemtic Name: ethyl 2-azanyl-4-(5-bromanylthiophen-2-yl)-5-oxidanylidene-1-phenyl-4,6,7,8-tetrahydroquinoline-3-carboxylate Openeye Name: ethyl 2-amino-4-(5-bromo-2-thienyl)-5-oxo-1-phenyl-4,6,7,8-tetrahydroquinoline-3-carboxylate CAS Name: 2-amino-4-(5-bromo-2-thiophenyl)-5-oxo-1-phenyl-4,6,7,8-tetrahydroquinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-4-(5-bromothiophen-2-yl)-5-oxo-1-phenyl-4,6,7,8-tetrahydroquinoline-3-carboxylate Traditional Name: 2-amino-4-(5-bromo-2-thienyl)-5-keto-1-phenyl-4,6,7,8-tetrahydroquinoline-3-carboxylic acid ethyl ester Formula: C22H21BrN2O3S MolecularWeight: 473.38274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C(C1C3=CC=C(S3)Br)C(=O)CCC2)C4=CC=CC=C4)N

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C(C1C3=CC=C(S3)Br)C(=O)CCC2)C4=CC=CC=C4)N

InChI

InChI=1S/C22H21BrN2O3S/c1-2-28-22(27)20-19(16-11-12-17(23)29-16)18-14(9-6-10-15(18)26)25(21(20)24)13-7-4-3-5-8-13/h3-5,7-8,11-12,19H,2,6,9-10,24H2,1H3