N-(3-bromophenyl)-1-(4-propan-2-ylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(3-bromophenyl)-1-(4-propan-2-ylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(3-bromophenyl)-1-(4-isopropylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(3-bromophenyl)-1-(4-propan-2-ylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(3-bromophenyl)-1-(4-propan-2-ylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(3-bromophenyl)-1-p-cumenylsulfonyl-isonipecotamide Formula: C21H25BrN2O3S MolecularWeight: 465.4038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC(=CC=C3)Br

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC(=CC=C3)Br

InChI

InChI=1S/C21H25BrN2O3S/c1-15(2)16-6-8-20(9-7-16)28(26,27)24-12-10-17(11-13-24)21(25)23-19-5-3-4-18(22)14-19/h3-9,14-15,17H,10-13H2,1-2H3,(H,23,25)