N-(cyanomethyl)-4-methyl-2-[[3-methyl-4-(4-morpholin-4-ylphenyl)-1,2-thiazol-5-yl]amino]pentanamide

Systemtic Name: N-(cyanomethyl)-4-methyl-2-[[3-methyl-4-(4-morpholin-4-ylphenyl)-1,2-thiazol-5-yl]amino]pentanamide Openeye Name: N-(cyanomethyl)-4-methyl-2-[[3-methyl-4-(4-morpholinophenyl)isothiazol-5-yl]amino]pentanamide CAS Name: N-(cyanomethyl)-4-methyl-2-[[3-methyl-4-[4-(4-morpholinyl)phenyl]-5-isothiazolyl]amino]pentanamide IUPAC Name: N-(cyanomethyl)-4-methyl-2-[[3-methyl-4-(4-morpholin-4-ylphenyl)-1,2-thiazol-5-yl]amino]pentanamide Traditional Name: N-(cyanomethyl)-4-methyl-2-[[3-methyl-4-(4-morpholinophenyl)isothiazol-5-yl]amino]valeramide Formula: C22H29N5O2S MolecularWeight: 427.56296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NSC(=C1C2=CC=C(C=C2)N3CCOCC3)NC(CC(C)C)C(=O)NCC#N

Isomeric SMILES

CC1=NSC(=C1C2=CC=C(C=C2)N3CCOCC3)NC(CC(C)C)C(=O)NCC#N

InChI

InChI=1S/C22H29N5O2S/c1-15(2)14-19(21(28)24-9-8-23)25-22-20(16(3)26-30-22)17-4-6-18(7-5-17)27-10-12-29-13-11-27/h4-7,15,19,25H,9-14H2,1-3H3,(H,24,28)