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

Systemtic Name: methyl 4-[(3-azanyl-6-methyl-thieno[2,3-b]quinolin-2-yl)carbonylamino]benzoate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C21H17N3O3S MolecularWeight: 391.44298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC3=C(N=C2C=C1)SC(=C3N)C(=O)NC4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CC1=CC2=CC3=C(N=C2C=C1)SC(=C3N)C(=O)NC4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C21H17N3O3S/c1-11-3-8-16-13(9-11)10-15-17(22)18(28-20(15)24-16)19(25)23-14-6-4-12(5-7-14)21(26)27-2/h3-10H,22H2,1-2H3,(H,23,25)