N-[3-(2,4-dimethylphenyl)propyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[3-(2,4-dimethylphenyl)propyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[3-(2,4-dimethylphenyl)propyl]-1-(2-thienylsulfonyl)piperidine-4-carboxamide CAS Name: N-[3-(2,4-dimethylphenyl)propyl]-1-thiophen-2-ylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[3-(2,4-dimethylphenyl)propyl]-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[3-(2,4-dimethylphenyl)propyl]-1-(2-thienylsulfonyl)isonipecotamide Formula: C21H28N2O3S2 MolecularWeight: 420.58862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CCCNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3)C

Isomeric SMILES

CC1=CC(=C(C=C1)CCCNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3)C

InChI

InChI=1S/C21H28N2O3S2/c1-16-7-8-18(17(2)15-16)5-3-11-22-21(24)19-9-12-23(13-10-19)28(25,26)20-6-4-14-27-20/h4,6-8,14-15,19H,3,5,9-13H2,1-2H3,(H,22,24)