N-[1-(3-acetamidophenyl)ethyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[1-(3-acetamidophenyl)ethyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[1-(3-acetamidophenyl)ethyl]-1-(2-thienylsulfonyl)piperidine-4-carboxamide CAS Name: N-[1-(3-acetamidophenyl)ethyl]-1-thiophen-2-ylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[1-(3-acetamidophenyl)ethyl]-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[1-(3-acetamidophenyl)ethyl]-1-(2-thienylsulfonyl)isonipecotamide Formula: C20H25N3O4S2 MolecularWeight: 435.5602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25N3O4S2/c1-14(17-5-3-6-18(13-17)22-15(2)24)21-20(25)16-8-10-23(11-9-16)29(26,27)19-7-4-12-28-19/h3-7,12-14,16H,8-11H2,1-2H3,(H,21,25)(H,22,24)