N-(3-methylsulfanylphenyl)-2-(5-piperidin-1-ylsulfonylthiophen-2-yl)ethanamide

Systemtic Name: N-(3-methylsulfanylphenyl)-2-(5-piperidin-1-ylsulfonylthiophen-2-yl)ethanamide Openeye Name: N-(3-methylsulfanylphenyl)-2-[5-(1-piperidylsulfonyl)-2-thienyl]acetamide CAS Name: N-[3-(methylthio)phenyl]-2-[5-(1-piperidinylsulfonyl)-2-thiophenyl]acetamide IUPAC Name: N-(3-methylsulfanylphenyl)-2-(5-piperidin-1-ylsulfonylthiophen-2-yl)acetamide Traditional Name: N-[3-(methylthio)phenyl]-2-(5-piperidinosulfonyl-2-thienyl)acetamide Formula: C18H22N2O3S3 MolecularWeight: 410.57388

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC(=O)CC2=CC=C(S2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CSC1=CC=CC(=C1)NC(=O)CC2=CC=C(S2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C18H22N2O3S3/c1-24-15-7-5-6-14(12-15)19-17(21)13-16-8-9-18(25-16)26(22,23)20-10-3-2-4-11-20/h5-9,12H,2-4,10-11,13H2,1H3,(H,19,21)