N-[4-(4-methylsulfonylpiperazin-1-yl)phenyl]-2-pyridin-2-ylsulfanyl-ethanamide

Systemtic Name: N-[4-(4-methylsulfonylpiperazin-1-yl)phenyl]-2-pyridin-2-ylsulfanyl-ethanamide Openeye Name: N-[4-(4-methylsulfonylpiperazin-1-yl)phenyl]-2-(2-pyridylsulfanyl)acetamide CAS Name: N-[4-(4-methylsulfonyl-1-piperazinyl)phenyl]-2-(2-pyridinylthio)acetamide IUPAC Name: N-[4-(4-methylsulfonylpiperazin-1-yl)phenyl]-2-pyridin-2-ylsulfanylacetamide Traditional Name: N-[4-(4-mesylpiperazino)phenyl]-2-(2-pyridylthio)acetamide Formula: C18H22N4O3S2 MolecularWeight: 406.52228

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)CSC3=CC=CC=N3

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)CSC3=CC=CC=N3

InChI

InChI=1S/C18H22N4O3S2/c1-27(24,25)22-12-10-21(11-13-22)16-7-5-15(6-8-16)20-17(23)14-26-18-4-2-3-9-19-18/h2-9H,10-14H2,1H3,(H,20,23)