3-methyl-N-(4-methyl-3-morpholin-4-ylcarbonyl-5-phenyl-thiophen-2-yl)-1-oxidanylidene-4H-isochromene-3-carboxamide

Systemtic Name: 3-methyl-N-(4-methyl-3-morpholin-4-ylcarbonyl-5-phenyl-thiophen-2-yl)-1-oxidanylidene-4H-isochromene-3-carboxamide Openeye Name: 3-methyl-N-[4-methyl-3-(morpholine-4-carbonyl)-5-phenyl-2-thienyl]-1-oxo-isochromane-3-carboxamide CAS Name: 3-methyl-N-[4-methyl-3-[4-morpholinyl(oxo)methyl]-5-phenyl-2-thiophenyl]-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: 3-methyl-N-[4-methyl-3-(morpholine-4-carbonyl)-5-phenylthiophen-2-yl]-1-oxo-4H-isochromene-3-carboxamide Traditional Name: 1-keto-3-methyl-N-[4-methyl-3-(morpholine-4-carbonyl)-5-phenyl-2-thienyl]isochroman-3-carboxamide Formula: C27H26N2O5S MolecularWeight: 490.57074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N2CCOCC2)NC(=O)C3(CC4=CC=CC=C4C(=O)O3)C)C5=CC=CC=C5

Isomeric SMILES

CC1=C(SC(=C1C(=O)N2CCOCC2)NC(=O)C3(CC4=CC=CC=C4C(=O)O3)C)C5=CC=CC=C5

InChI

InChI=1S/C27H26N2O5S/c1-17-21(24(30)29-12-14-33-15-13-29)23(35-22(17)18-8-4-3-5-9-18)28-26(32)27(2)16-19-10-6-7-11-20(19)25(31)34-27/h3-11H,12-16H2,1-2H3,(H,28,32)