3-azanyl-4-(4-bromophenyl)-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxylic acid

Systemtic Name: 3-azanyl-4-(4-bromophenyl)-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxylic acid Openeye Name: 3-amino-4-(4-bromophenyl)-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxylic acid CAS Name: 3-amino-4-(4-bromophenyl)-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxylic acid IUPAC Name: 3-amino-4-(4-bromophenyl)-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxylic acid Traditional Name: 3-amino-4-(4-bromophenyl)-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxylic acid Formula: C18H15BrN2O2S MolecularWeight: 403.2929

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C3C(=C(SC3=N2)C(=O)O)N)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CCC2=C(C1)C(=C3C(=C(SC3=N2)C(=O)O)N)C4=CC=C(C=C4)Br

InChI

InChI=1S/C18H15BrN2O2S/c19-10-7-5-9(6-8-10)13-11-3-1-2-4-12(11)21-17-14(13)15(20)16(24-17)18(22)23/h5-8H,1-4,20H2,(H,22,23)