2-[4-(5-chloranyl-1,3-benzothiazol-2-yl)piperidin-1-yl]-N-(2-cyano-3-methyl-butan-2-yl)ethanamide

Systemtic Name: 2-[4-(5-chloranyl-1,3-benzothiazol-2-yl)piperidin-1-yl]-N-(2-cyano-3-methyl-butan-2-yl)ethanamide Openeye Name: 2-[4-(5-chloro-1,3-benzothiazol-2-yl)-1-piperidyl]-N-(1-cyano-1,2-dimethyl-propyl)acetamide CAS Name: 2-[4-(5-chloro-1,3-benzothiazol-2-yl)-1-piperidinyl]-N-(2-cyano-3-methylbutan-2-yl)acetamide IUPAC Name: 2-[4-(5-chloro-1,3-benzothiazol-2-yl)piperidin-1-yl]-N-(2-cyano-3-methylbutan-2-yl)acetamide Traditional Name: 2-[4-(5-chloro-1,3-benzothiazol-2-yl)piperidino]-N-(1-cyano-1,2-dimethyl-propyl)acetamide Formula: C20H25ClN4OS MolecularWeight: 404.9567

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(C#N)NC(=O)CN1CCC(CC1)C2=NC3=C(S2)C=CC(=C3)Cl

Isomeric SMILES

CC(C)C(C)(C#N)NC(=O)CN1CCC(CC1)C2=NC3=C(S2)C=CC(=C3)Cl

InChI

InChI=1S/C20H25ClN4OS/c1-13(2)20(3,12-22)24-18(26)11-25-8-6-14(7-9-25)19-23-16-10-15(21)4-5-17(16)27-19/h4-5,10,13-14H,6-9,11H2,1-3H3,(H,24,26)