ethyl (4R)-2-azanyl-1-(4-bromophenyl)-4-(5-tert-butylthiophen-2-yl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carboxylate

Systemtic Name: ethyl (4R)-2-azanyl-1-(4-bromophenyl)-4-(5-tert-butylthiophen-2-yl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carboxylate Openeye Name: ethyl (4R)-2-amino-1-(4-bromophenyl)-4-(5-tert-butyl-2-thienyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carboxylate CAS Name: (4R)-2-amino-1-(4-bromophenyl)-4-(5-tert-butyl-2-thiophenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl (4R)-2-amino-1-(4-bromophenyl)-4-(5-tert-butylthiophen-2-yl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carboxylate Traditional Name: (4R)-2-amino-1-(4-bromophenyl)-4-(5-tert-butyl-2-thienyl)-5-keto-4,6,7,8-tetrahydroquinoline-3-carboxylic acid ethyl ester Formula: C26H29BrN2O3S MolecularWeight: 529.48906

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C([C@H]1C3=CC=C(S3)C(C)(C)C)C(=O)CCC2)C4=CC=C(C=C4)Br)N

InChI

InChI=1S/C26H29BrN2O3S/c1-5-32-25(31)23-22(19-13-14-20(33-19)26(2,3)4)21-17(7-6-8-18(21)30)29(24(23)28)16-11-9-15(27)10-12-16/h9-14,22H,5-8,28H2,1-4H3/t22-/m1/s1