N-[1-(4-methoxyphenyl)-3-methyl-butyl]-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[1-(4-methoxyphenyl)-3-methyl-butyl]-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide Openeye Name: N-[1-(4-methoxyphenyl)-3-methyl-butyl]-1-(2-thienylsulfonyl)piperidine-3-carboxamide CAS Name: N-[1-(4-methoxyphenyl)-3-methylbutyl]-1-thiophen-2-ylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-[1-(4-methoxyphenyl)-3-methylbutyl]-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide Traditional Name: N-[1-(4-methoxyphenyl)-3-methyl-butyl]-1-(2-thienylsulfonyl)nipecotamide Formula: C22H30N2O4S2 MolecularWeight: 450.6146

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=C(C=C1)OC)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC(C)CC(C1=CC=C(C=C1)OC)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C22H30N2O4S2/c1-16(2)14-20(17-8-10-19(28-3)11-9-17)23-22(25)18-6-4-12-24(15-18)30(26,27)21-7-5-13-29-21/h5,7-11,13,16,18,20H,4,6,12,14-15H2,1-3H3,(H,23,25)