N-(3-bromophenyl)-1-thiophen-2-ylsulfonyl-piperidine-2-carboxamide

Systemtic Name: N-(3-bromophenyl)-1-thiophen-2-ylsulfonyl-piperidine-2-carboxamide Openeye Name: N-(3-bromophenyl)-1-(2-thienylsulfonyl)piperidine-2-carboxamide CAS Name: N-(3-bromophenyl)-1-thiophen-2-ylsulfonyl-2-piperidinecarboxamide IUPAC Name: N-(3-bromophenyl)-1-thiophen-2-ylsulfonylpiperidine-2-carboxamide Traditional Name: N-(3-bromophenyl)-1-(2-thienylsulfonyl)pipecolinamide Formula: C16H17BrN2O3S2 MolecularWeight: 429.35178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)NC2=CC(=CC=C2)Br)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

C1CCN(C(C1)C(=O)NC2=CC(=CC=C2)Br)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C16H17BrN2O3S2/c17-12-5-3-6-13(11-12)18-16(20)14-7-1-2-9-19(14)24(21,22)15-8-4-10-23-15/h3-6,8,10-11,14H,1-2,7,9H2,(H,18,20)