2-[(3-azanyl-6-ethoxy-thieno[2,3-b]quinolin-2-yl)carbonyl-phenyl-amino]ethanoic acid

Systemtic Name: 2-[(3-azanyl-6-ethoxy-thieno[2,3-b]quinolin-2-yl)carbonyl-phenyl-amino]ethanoic acid Openeye Name: 2-(N-(3-amino-6-ethoxy-thieno[2,3-b]quinoline-2-carbonyl)anilino)acetic acid CAS Name: 2-(N-[(3-amino-6-ethoxy-2-thieno[2,3-b]quinolinyl)-oxomethyl]anilino)acetic acid IUPAC Name: 2-(N-(3-amino-6-ethoxythieno[2,3-b]quinoline-2-carbonyl)anilino)acetic acid Traditional Name: 2-(N-(3-amino-6-ethoxy-thieno[2,3-b]quinoline-2-carbonyl)anilino)acetic acid Formula: C22H19N3O4S MolecularWeight: 421.46896

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=CC3=C(N=C2C=C1)SC(=C3N)C(=O)N(CC(=O)O)C4=CC=CC=C4

Isomeric SMILES

CCOC1=CC2=CC3=C(N=C2C=C1)SC(=C3N)C(=O)N(CC(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C22H19N3O4S/c1-2-29-15-8-9-17-13(10-15)11-16-19(23)20(30-21(16)24-17)22(28)25(12-18(26)27)14-6-4-3-5-7-14/h3-11H,2,12,23H2,1H3,(H,26,27)