2-[(4-tert-butylphenyl)-methylsulfonyl-amino]-N-(3-piperidin-1-ylpropyl)ethanamide

Systemtic Name: 2-[(4-tert-butylphenyl)-methylsulfonyl-amino]-N-(3-piperidin-1-ylpropyl)ethanamide Openeye Name: 2-(4-tert-butyl-N-methylsulfonyl-anilino)-N-[3-(1-piperidyl)propyl]acetamide CAS Name: 2-(4-tert-butyl-N-methylsulfonylanilino)-N-[3-(1-piperidinyl)propyl]acetamide IUPAC Name: 2-(4-tert-butyl-N-methylsulfonylanilino)-N-(3-piperidin-1-ylpropyl)acetamide Traditional Name: 2-(4-tert-butyl-N-mesyl-anilino)-N-(3-piperidinopropyl)acetamide Formula: C21H35N3O3S MolecularWeight: 409.5859

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)N(CC(=O)NCCCN2CCCCC2)S(=O)(=O)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)N(CC(=O)NCCCN2CCCCC2)S(=O)(=O)C

InChI

InChI=1S/C21H35N3O3S/c1-21(2,3)18-9-11-19(12-10-18)24(28(4,26)27)17-20(25)22-13-8-16-23-14-6-5-7-15-23/h9-12H,5-8,13-17H2,1-4H3,(H,22,25)