2-[4-[2-(tert-butylamino)-2-oxidanylidene-ethyl]piperazin-1-yl]-N-(2-chloranyl-5-methylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-[4-[2-(tert-butylamino)-2-oxidanylidene-ethyl]piperazin-1-yl]-N-(2-chloranyl-5-methylsulfonyl-phenyl)ethanamide Openeye Name: 2-[4-[2-(tert-butylamino)-2-oxo-ethyl]piperazin-1-yl]-N-(2-chloro-5-methylsulfonyl-phenyl)acetamide CAS Name: 2-[4-[2-(tert-butylamino)-2-oxoethyl]-1-piperazinyl]-N-(2-chloro-5-methylsulfonylphenyl)acetamide IUPAC Name: 2-[4-[2-(tert-butylamino)-2-oxoethyl]piperazin-1-yl]-N-(2-chloro-5-methylsulfonylphenyl)acetamide Traditional Name: 2-[4-[2-(tert-butylamino)-2-keto-ethyl]piperazino]-N-(2-chloro-5-mesyl-phenyl)acetamide Formula: C19H29ClN4O4S MolecularWeight: 444.97596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CN1CCN(CC1)CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)C)Cl

Isomeric SMILES

CC(C)(C)NC(=O)CN1CCN(CC1)CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)C)Cl

InChI

InChI=1S/C19H29ClN4O4S/c1-19(2,3)22-18(26)13-24-9-7-23(8-10-24)12-17(25)21-16-11-14(29(4,27)28)5-6-15(16)20/h5-6,11H,7-10,12-13H2,1-4H3,(H,21,25)(H,22,26)