2-tert-butyl-4-[(6-morpholin-4-ylpyridin-3-yl)amino]-1,1-bis(oxidanylidene)-5-phenyl-1,2-thiazol-3-one

Systemtic Name: 2-tert-butyl-4-[(6-morpholin-4-ylpyridin-3-yl)amino]-1,1-bis(oxidanylidene)-5-phenyl-1,2-thiazol-3-one Openeye Name: 2-tert-butyl-4-[(6-morpholino-3-pyridyl)amino]-1,1-dioxo-5-phenyl-isothiazol-3-one CAS Name: 2-tert-butyl-4-[[6-(4-morpholinyl)-3-pyridinyl]amino]-1,1-dioxo-5-phenyl-3-isothiazolone IUPAC Name: 2-tert-butyl-4-[(6-morpholin-4-ylpyridin-3-yl)amino]-1,1-dioxo-5-phenyl-1,2-thiazol-3-one Traditional Name: 2-tert-butyl-1,1-diketo-4-[(6-morpholino-3-pyridyl)amino]-5-phenyl-isothiazol-3-one Formula: C22H26N4O4S MolecularWeight: 442.53124

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=O)C(=C(S1(=O)=O)C2=CC=CC=C2)NC3=CN=C(C=C3)N4CCOCC4

Isomeric SMILES

CC(C)(C)N1C(=O)C(=C(S1(=O)=O)C2=CC=CC=C2)NC3=CN=C(C=C3)N4CCOCC4

InChI

InChI=1S/C22H26N4O4S/c1-22(2,3)26-21(27)19(20(31(26,28)29)16-7-5-4-6-8-16)24-17-9-10-18(23-15-17)25-11-13-30-14-12-25/h4-10,15,24H,11-14H2,1-3H3