2-methyl-2-morpholin-4-ylcarbonyl-3-oxidanylidene-4-[4-(1,2-thiazol-3-yloxy)phenoxy]pentanenitrile

Systemtic Name: 2-methyl-2-morpholin-4-ylcarbonyl-3-oxidanylidene-4-[4-(1,2-thiazol-3-yloxy)phenoxy]pentanenitrile Openeye Name: 4-(4-isothiazol-3-yloxyphenoxy)-2-methyl-2-(morpholine-4-carbonyl)-3-oxo-pentanenitrile CAS Name: 4-[4-(3-isothiazolyloxy)phenoxy]-2-methyl-2-[4-morpholinyl(oxo)methyl]-3-oxopentanenitrile IUPAC Name: 2-methyl-2-(morpholine-4-carbonyl)-3-oxo-4-[4-(1,2-thiazol-3-yloxy)phenoxy]pentanenitrile Traditional Name: 4-(4-isothiazol-3-yloxyphenoxy)-3-keto-2-methyl-2-(morpholine-4-carbonyl)valeronitrile Formula: C20H21N3O5S MolecularWeight: 415.46284

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C(C)(C#N)C(=O)N1CCOCC1)OC2=CC=C(C=C2)OC3=NSC=C3

Isomeric SMILES

CC(C(=O)C(C)(C#N)C(=O)N1CCOCC1)OC2=CC=C(C=C2)OC3=NSC=C3

InChI

InChI=1S/C20H21N3O5S/c1-14(18(24)20(2,13-21)19(25)23-8-10-26-11-9-23)27-15-3-5-16(6-4-15)28-17-7-12-29-22-17/h3-7,12,14H,8-11H2,1-2H3