1-(5-methylthiophen-2-yl)sulfonyl-N-[3-(pyrrolidin-1-ylmethyl)phenyl]piperidine-3-carboxamide

Systemtic Name: 1-(5-methylthiophen-2-yl)sulfonyl-N-[3-(pyrrolidin-1-ylmethyl)phenyl]piperidine-3-carboxamide Openeye Name: 1-[(5-methyl-2-thienyl)sulfonyl]-N-[3-(pyrrolidin-1-ylmethyl)phenyl]piperidine-3-carboxamide CAS Name: 1-[(5-methyl-2-thiophenyl)sulfonyl]-N-[3-(1-pyrrolidinylmethyl)phenyl]-3-piperidinecarboxamide IUPAC Name: 1-(5-methylthiophen-2-yl)sulfonyl-N-[3-(pyrrolidin-1-ylmethyl)phenyl]piperidine-3-carboxamide Traditional Name: 1-[(5-methyl-2-thienyl)sulfonyl]-N-[3-(pyrrolidinomethyl)phenyl]nipecotamide Formula: C22H29N3O3S2 MolecularWeight: 447.61396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=CC=CC(=C3)CN4CCCC4

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=CC=CC(=C3)CN4CCCC4

InChI

InChI=1S/C22H29N3O3S2/c1-17-9-10-21(29-17)30(27,28)25-13-5-7-19(16-25)22(26)23-20-8-4-6-18(14-20)15-24-11-2-3-12-24/h4,6,8-10,14,19H,2-3,5,7,11-13,15-16H2,1H3,(H,23,26)