N-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]-1-(5-methylthiophen-2-yl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]-1-(5-methylthiophen-2-yl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]-1-[(5-methyl-2-thienyl)sulfonyl]piperidine-3-carboxamide CAS Name: N-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]-1-[(5-methyl-2-thiophenyl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]-1-(5-methylthiophen-2-yl)sulfonylpiperidine-3-carboxamide Traditional Name: N-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]-1-[(5-methyl-2-thienyl)sulfonyl]nipecotamide Formula: C21H28FN3O3S2 MolecularWeight: 453.593723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)NCC(C3=CC(=CC=C3)F)N(C)C

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)NCC(C3=CC(=CC=C3)F)N(C)C

InChI

InChI=1S/C21H28FN3O3S2/c1-15-9-10-20(29-15)30(27,28)25-11-5-7-17(14-25)21(26)23-13-19(24(2)3)16-6-4-8-18(22)12-16/h4,6,8-10,12,17,19H,5,7,11,13-14H2,1-3H3,(H,23,26)