ethyl 4-[(3-azanyl-6-methyl-thieno[2,3-b]quinolin-2-yl)carbonylamino]benzoate

Systemtic Name: ethyl 4-[(3-azanyl-6-methyl-thieno[2,3-b]quinolin-2-yl)carbonylamino]benzoate Openeye Name: ethyl 4-[(3-amino-6-methyl-thieno[2,3-b]quinoline-2-carbonyl)amino]benzoate CAS Name: 4-[[(3-amino-6-methyl-2-thieno[2,3-b]quinolinyl)-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(3-amino-6-methylthieno[2,3-b]quinoline-2-carbonyl)amino]benzoate Traditional Name: 4-[(3-amino-6-methyl-thieno[2,3-b]quinoline-2-carbonyl)amino]benzoic acid ethyl ester Formula: C22H19N3O3S MolecularWeight: 405.46956

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H19N3O3S/c1-3-28-22(27)13-5-7-15(8-6-13)24-20(26)19-18(23)16-11-14-10-12(2)4-9-17(14)25-21(16)29-19/h4-11H,3,23H2,1-2H3,(H,24,26)