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

Systemtic Name: N-[4-(4-methylsulfonylpiperazin-1-yl)phenyl]-2-naphthalen-1-ylsulfanyl-ethanamide Openeye Name: N-[4-(4-methylsulfonylpiperazin-1-yl)phenyl]-2-(1-naphthylsulfanyl)acetamide CAS Name: N-[4-(4-methylsulfonyl-1-piperazinyl)phenyl]-2-(1-naphthalenylthio)acetamide IUPAC Name: N-[4-(4-methylsulfonylpiperazin-1-yl)phenyl]-2-naphthalen-1-ylsulfanylacetamide Traditional Name: N-[4-(4-mesylpiperazino)phenyl]-2-(1-naphthylthio)acetamide Formula: C23H25N3O3S2 MolecularWeight: 455.5929

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)CSC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)CSC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C23H25N3O3S2/c1-31(28,29)26-15-13-25(14-16-26)20-11-9-19(10-12-20)24-23(27)17-30-22-8-4-6-18-5-2-3-7-21(18)22/h2-12H,13-17H2,1H3,(H,24,27)