ethyl 2-[(6,7-dimethoxy-2-methyl-1-oxidanylidene-3-thiophen-2-yl-3,4-dihydroisoquinolin-4-yl)carbonylamino]benzoate

Systemtic Name: ethyl 2-[(6,7-dimethoxy-2-methyl-1-oxidanylidene-3-thiophen-2-yl-3,4-dihydroisoquinolin-4-yl)carbonylamino]benzoate Openeye Name: ethyl 2-[[6,7-dimethoxy-2-methyl-1-oxo-3-(2-thienyl)-3,4-dihydroisoquinoline-4-carbonyl]amino]benzoate CAS Name: 2-[[(6,7-dimethoxy-2-methyl-1-oxo-3-thiophen-2-yl-3,4-dihydroisoquinolin-4-yl)-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[(6,7-dimethoxy-2-methyl-1-oxo-3-thiophen-2-yl-3,4-dihydroisoquinoline-4-carbonyl)amino]benzoate Traditional Name: 2-[[1-keto-6,7-dimethoxy-2-methyl-3-(2-thienyl)-3,4-dihydroisoquinoline-4-carbonyl]amino]benzoic acid ethyl ester Formula: C26H26N2O6S MolecularWeight: 494.55944

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC(=O)C2C(N(C(=O)C3=CC(=C(C=C23)OC)OC)C)C4=CC=CS4

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC(=O)C2C(N(C(=O)C3=CC(=C(C=C23)OC)OC)C)C4=CC=CS4

InChI

InChI=1S/C26H26N2O6S/c1-5-34-26(31)15-9-6-7-10-18(15)27-24(29)22-16-13-19(32-3)20(33-4)14-17(16)25(30)28(2)23(22)21-11-8-12-35-21/h6-14,22-23H,5H2,1-4H3,(H,27,29)