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

Systemtic Name: N-(cyanomethyl)-4-methyl-2-[(3-methyl-4-phenyl-1,2-thiazol-5-yl)amino]pentanamide Openeye Name: N-(cyanomethyl)-4-methyl-2-[(3-methyl-4-phenyl-isothiazol-5-yl)amino]pentanamide CAS Name: N-(cyanomethyl)-4-methyl-2-[(3-methyl-4-phenyl-5-isothiazolyl)amino]pentanamide IUPAC Name: N-(cyanomethyl)-4-methyl-2-[(3-methyl-4-phenyl-1,2-thiazol-5-yl)amino]pentanamide Traditional Name: N-(cyanomethyl)-4-methyl-2-[(3-methyl-4-phenyl-isothiazol-5-yl)amino]valeramide Formula: C18H22N4OS MolecularWeight: 342.45848

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N4OS/c1-12(2)11-15(17(23)20-10-9-19)21-18-16(13(3)22-24-18)14-7-5-4-6-8-14/h4-8,12,15,21H,10-11H2,1-3H3,(H,20,23)