propan-2-yl 4-[(6,8-dimethyl-2-thiophen-2-yl-quinolin-4-yl)carbonylamino]benzoate

Systemtic Name: propan-2-yl 4-[(6,8-dimethyl-2-thiophen-2-yl-quinolin-4-yl)carbonylamino]benzoate Openeye Name: isopropyl 4-[[6,8-dimethyl-2-(2-thienyl)quinoline-4-carbonyl]amino]benzoate CAS Name: 4-[[(6,8-dimethyl-2-thiophen-2-yl-4-quinolinyl)-oxomethyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[(6,8-dimethyl-2-thiophen-2-ylquinoline-4-carbonyl)amino]benzoate Traditional Name: 4-[[6,8-dimethyl-2-(2-thienyl)quinoline-4-carbonyl]amino]benzoic acid isopropyl ester Formula: C26H24N2O3S MolecularWeight: 444.54536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CC(=N2)C3=CC=CS3)C(=O)NC4=CC=C(C=C4)C(=O)OC(C)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CC(=N2)C3=CC=CS3)C(=O)NC4=CC=C(C=C4)C(=O)OC(C)C)C

InChI

InChI=1S/C26H24N2O3S/c1-15(2)31-26(30)18-7-9-19(10-8-18)27-25(29)21-14-22(23-6-5-11-32-23)28-24-17(4)12-16(3)13-20(21)24/h5-15H,1-4H3,(H,27,29)