N-(2-morpholin-4-yl-5-morpholin-4-ylsulfonyl-phenyl)-1,3-bis(oxidanylidene)-2-(pyridin-4-ylmethyl)isoindole-5-carboxamide

Systemtic Name: N-(2-morpholin-4-yl-5-morpholin-4-ylsulfonyl-phenyl)-1,3-bis(oxidanylidene)-2-(pyridin-4-ylmethyl)isoindole-5-carboxamide Openeye Name: N-(2-morpholino-5-morpholinosulfonyl-phenyl)-1,3-dioxo-2-(4-pyridylmethyl)isoindoline-5-carboxamide CAS Name: N-[2-(4-morpholinyl)-5-(4-morpholinylsulfonyl)phenyl]-1,3-dioxo-2-(pyridin-4-ylmethyl)-5-isoindolecarboxamide IUPAC Name: N-(2-morpholin-4-yl-5-morpholin-4-ylsulfonylphenyl)-1,3-dioxo-2-(pyridin-4-ylmethyl)isoindole-5-carboxamide Traditional Name: 1,3-diketo-N-(2-morpholino-5-morpholinosulfonyl-phenyl)-2-(4-pyridylmethyl)isoindoline-5-carboxamide Formula: C29H29N5O7S MolecularWeight: 591.63486

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)C4=CC5=C(C=C4)C(=O)N(C5=O)CC6=CC=NC=C6

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)C4=CC5=C(C=C4)C(=O)N(C5=O)CC6=CC=NC=C6

InChI

InChI=1S/C29H29N5O7S/c35-27(21-1-3-23-24(17-21)29(37)34(28(23)36)19-20-5-7-30-8-6-20)31-25-18-22(42(38,39)33-11-15-41-16-12-33)2-4-26(25)32-9-13-40-14-10-32/h1-8,17-18H,9-16,19H2,(H,31,35)