N-(4-pentylphenyl)-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-(4-pentylphenyl)-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide Openeye Name: N-(4-pentylphenyl)-1-(2-thienylsulfonyl)piperidine-3-carboxamide CAS Name: N-(4-pentylphenyl)-1-thiophen-2-ylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-(4-pentylphenyl)-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide Traditional Name: N-(4-amylphenyl)-1-(2-thienylsulfonyl)nipecotamide Formula: C21H28N2O3S2 MolecularWeight: 420.58862

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CCCCCC1=CC=C(C=C1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C21H28N2O3S2/c1-2-3-4-7-17-10-12-19(13-11-17)22-21(24)18-8-5-14-23(16-18)28(25,26)20-9-6-15-27-20/h6,9-13,15,18H,2-5,7-8,14,16H2,1H3,(H,22,24)