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

Systemtic Name: N-[2-(4-propan-2-ylphenyl)ethyl]-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide Openeye Name: N-[2-(4-isopropylphenyl)ethyl]-1-(2-thienylsulfonyl)piperidine-3-carboxamide CAS Name: N-[2-(4-propan-2-ylphenyl)ethyl]-1-thiophen-2-ylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-[2-(4-propan-2-ylphenyl)ethyl]-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide Traditional Name: N-(2-p-cumenylethyl)-1-(2-thienylsulfonyl)nipecotamide Formula: C21H28N2O3S2 MolecularWeight: 420.58862

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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