1-(2-azanylpyrrolidin-1-yl)-6-[(4-methylsulfonylphenyl)amino]hexan-1-one

Systemtic Name: 1-(2-azanylpyrrolidin-1-yl)-6-[(4-methylsulfonylphenyl)amino]hexan-1-one Openeye Name: 1-(2-aminopyrrolidin-1-yl)-6-(4-methylsulfonylanilino)hexan-1-one CAS Name: 1-(2-amino-1-pyrrolidinyl)-6-(4-methylsulfonylanilino)-1-hexanone IUPAC Name: 1-(2-aminopyrrolidin-1-yl)-6-(4-methylsulfonylanilino)hexan-1-one Traditional Name: 1-(2-aminopyrrolidino)-6-(4-mesylanilino)hexan-1-one Formula: C17H27N3O3S MolecularWeight: 353.47958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)NCCCCCC(=O)N2CCCC2N

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)NCCCCCC(=O)N2CCCC2N

InChI

InChI=1S/C17H27N3O3S/c1-24(22,23)15-10-8-14(9-11-15)19-12-4-2-3-7-17(21)20-13-5-6-16(20)18/h8-11,16,19H,2-7,12-13,18H2,1H3