methyl 3-[(3-azanyl-8-ethyl-thieno[2,3-b]quinolin-2-yl)carbonylamino]benzoate

Systemtic Name: methyl 3-[(3-azanyl-8-ethyl-thieno[2,3-b]quinolin-2-yl)carbonylamino]benzoate Openeye Name: methyl 3-[(3-amino-8-ethyl-thieno[2,3-b]quinoline-2-carbonyl)amino]benzoate CAS Name: 3-[[(3-amino-8-ethyl-2-thieno[2,3-b]quinolinyl)-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[(3-amino-8-ethylthieno[2,3-b]quinoline-2-carbonyl)amino]benzoate Traditional Name: 3-[(3-amino-8-ethyl-thieno[2,3-b]quinoline-2-carbonyl)amino]benzoic acid methyl ester Formula: C22H19N3O3S MolecularWeight: 405.46956

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=CC3=C(N=C21)SC(=C3N)C(=O)NC4=CC=CC(=C4)C(=O)OC

Isomeric SMILES

CCC1=CC=CC2=CC3=C(N=C21)SC(=C3N)C(=O)NC4=CC=CC(=C4)C(=O)OC

InChI

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