N-(cyanomethyl)-4-methyl-2-[2-(4-morpholin-4-ylphenyl)-1,3-thiazol-4-yl]pentanamide

Systemtic Name: N-(cyanomethyl)-4-methyl-2-[2-(4-morpholin-4-ylphenyl)-1,3-thiazol-4-yl]pentanamide Openeye Name: N-(cyanomethyl)-4-methyl-2-[2-(4-morpholinophenyl)thiazol-4-yl]pentanamide CAS Name: N-(cyanomethyl)-4-methyl-2-[2-[4-(4-morpholinyl)phenyl]-4-thiazolyl]pentanamide IUPAC Name: N-(cyanomethyl)-4-methyl-2-[2-(4-morpholin-4-ylphenyl)-1,3-thiazol-4-yl]pentanamide Traditional Name: N-(cyanomethyl)-4-methyl-2-[2-(4-morpholinophenyl)thiazol-4-yl]valeramide Formula: C21H26N4O2S MolecularWeight: 398.52174

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CSC(=N1)C2=CC=C(C=C2)N3CCOCC3)C(=O)NCC#N

Isomeric SMILES

CC(C)CC(C1=CSC(=N1)C2=CC=C(C=C2)N3CCOCC3)C(=O)NCC#N

InChI

InChI=1S/C21H26N4O2S/c1-15(2)13-18(20(26)23-8-7-22)19-14-28-21(24-19)16-3-5-17(6-4-16)25-9-11-27-12-10-25/h3-6,14-15,18H,8-13H2,1-2H3,(H,23,26)