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

Systemtic Name: 2-[(4-tert-butylphenyl)-methylsulfonyl-amino]-N-(3-pyrrolidin-1-ylpropyl)ethanamide Openeye Name: 2-(4-tert-butyl-N-methylsulfonyl-anilino)-N-(3-pyrrolidin-1-ylpropyl)acetamide CAS Name: 2-(4-tert-butyl-N-methylsulfonylanilino)-N-[3-(1-pyrrolidinyl)propyl]acetamide IUPAC Name: 2-(4-tert-butyl-N-methylsulfonylanilino)-N-(3-pyrrolidin-1-ylpropyl)acetamide Traditional Name: 2-(4-tert-butyl-N-mesyl-anilino)-N-(3-pyrrolidinopropyl)acetamide Formula: C20H33N3O3S MolecularWeight: 395.55932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)N(CC(=O)NCCCN2CCCC2)S(=O)(=O)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)N(CC(=O)NCCCN2CCCC2)S(=O)(=O)C

InChI

InChI=1S/C20H33N3O3S/c1-20(2,3)17-8-10-18(11-9-17)23(27(4,25)26)16-19(24)21-12-7-15-22-13-5-6-14-22/h8-11H,5-7,12-16H2,1-4H3,(H,21,24)