3-azanyl-N-phenyl-4-thiophen-2-yl-5,6,7,8-tetrahydrothieno[2,3-b]quinolin-9-ium-2-carboxamide

Systemtic Name: 3-azanyl-N-phenyl-4-thiophen-2-yl-5,6,7,8-tetrahydrothieno[2,3-b]quinolin-9-ium-2-carboxamide Openeye Name: 3-amino-N-phenyl-4-(2-thienyl)-5,6,7,8-tetrahydrothieno[2,3-b]quinolin-9-ium-2-carboxamide CAS Name: 3-amino-N-phenyl-4-thiophen-2-yl-5,6,7,8-tetrahydrothieno[2,3-b]quinolin-9-ium-2-carboxamide IUPAC Name: 3-amino-N-phenyl-4-thiophen-2-yl-5,6,7,8-tetrahydrothieno[2,3-b]quinolin-9-ium-2-carboxamide Traditional Name: 3-amino-N-phenyl-4-(2-thienyl)-5,6,7,8-tetrahydrothieno[2,3-b]quinolin-9-ium-2-carboxamide Formula: C22H20N3OS2+ MolecularWeight: 406.5437

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C3C(=C(SC3=[NH+]2)C(=O)NC4=CC=CC=C4)N)C5=CC=CS5

Isomeric SMILES

C1CCC2=C(C1)C(=C3C(=C(SC3=[NH+]2)C(=O)NC4=CC=CC=C4)N)C5=CC=CS5

InChI

InChI=1S/C22H19N3OS2/c23-19-18-17(16-11-6-12-27-16)14-9-4-5-10-15(14)25-22(18)28-20(19)21(26)24-13-7-2-1-3-8-13/h1-3,6-8,11-12H,4-5,9-10,23H2,(H,24,26)/p+1