N-(2-methyl-1-thiophen-2-yl-propyl)-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-methyl-1-thiophen-2-yl-propyl)-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-ethanamide Openeye Name: N-[2-methyl-1-(2-thienyl)propyl]-2-[[5-(1-piperidylsulfonyl)-2-pyridyl]sulfanyl]acetamide CAS Name: N-(2-methyl-1-thiophen-2-ylpropyl)-2-[[5-(1-piperidinylsulfonyl)-2-pyridinyl]thio]acetamide IUPAC Name: N-(2-methyl-1-thiophen-2-ylpropyl)-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanylacetamide Traditional Name: N-[2-methyl-1-(2-thienyl)propyl]-2-[(5-piperidinosulfonyl-2-pyridyl)thio]acetamide Formula: C20H27N3O3S3 MolecularWeight: 453.64168

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=CS1)NC(=O)CSC2=NC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC(C)C(C1=CC=CS1)NC(=O)CSC2=NC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C20H27N3O3S3/c1-15(2)20(17-7-6-12-27-17)22-18(24)14-28-19-9-8-16(13-21-19)29(25,26)23-10-4-3-5-11-23/h6-9,12-13,15,20H,3-5,10-11,14H2,1-2H3,(H,22,24)