ethyl 3-[(3-azanyl-6-methoxy-thieno[2,3-b]quinolin-2-yl)carbonylamino]benzoate

Systemtic Name: ethyl 3-[(3-azanyl-6-methoxy-thieno[2,3-b]quinolin-2-yl)carbonylamino]benzoate Openeye Name: ethyl 3-[(3-amino-6-methoxy-thieno[2,3-b]quinoline-2-carbonyl)amino]benzoate CAS Name: 3-[[(3-amino-6-methoxy-2-thieno[2,3-b]quinolinyl)-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[(3-amino-6-methoxythieno[2,3-b]quinoline-2-carbonyl)amino]benzoate Traditional Name: 3-[(3-amino-6-methoxy-thieno[2,3-b]quinoline-2-carbonyl)amino]benzoic acid ethyl ester Formula: C22H19N3O4S MolecularWeight: 421.46896

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)C2=C(C3=C(S2)N=C4C=CC(=CC4=C3)OC)N

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)C2=C(C3=C(S2)N=C4C=CC(=CC4=C3)OC)N

InChI

InChI=1S/C22H19N3O4S/c1-3-29-22(27)12-5-4-6-14(9-12)24-20(26)19-18(23)16-11-13-10-15(28-2)7-8-17(13)25-21(16)30-19/h4-11H,3,23H2,1-2H3,(H,24,26)