2-[(3,5-dimethylphenyl)-methylsulfonyl-amino]-N-(3-pyrrolidin-1-ylpropyl)propanamide

Systemtic Name: 2-[(3,5-dimethylphenyl)-methylsulfonyl-amino]-N-(3-pyrrolidin-1-ylpropyl)propanamide Openeye Name: 2-(3,5-dimethyl-N-methylsulfonyl-anilino)-N-(3-pyrrolidin-1-ylpropyl)propanamide CAS Name: 2-(3,5-dimethyl-N-methylsulfonylanilino)-N-[3-(1-pyrrolidinyl)propyl]propanamide IUPAC Name: 2-(3,5-dimethyl-N-methylsulfonylanilino)-N-(3-pyrrolidin-1-ylpropyl)propanamide Traditional Name: 2-(N-mesyl-3,5-dimethyl-anilino)-N-(3-pyrrolidinopropyl)propionamide Formula: C19H31N3O3S MolecularWeight: 381.53274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N(C(C)C(=O)NCCCN2CCCC2)S(=O)(=O)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)N(C(C)C(=O)NCCCN2CCCC2)S(=O)(=O)C)C

InChI

InChI=1S/C19H31N3O3S/c1-15-12-16(2)14-18(13-15)22(26(4,24)25)17(3)19(23)20-8-7-11-21-9-5-6-10-21/h12-14,17H,5-11H2,1-4H3,(H,20,23)