2-[5-(4-methylpiperazin-1-yl)sulfonylpyridin-2-yl]sulfanyl-N-phenethyl-ethanamide

Systemtic Name: 2-[5-(4-methylpiperazin-1-yl)sulfonylpyridin-2-yl]sulfanyl-N-phenethyl-ethanamide Openeye Name: 2-[[5-(4-methylpiperazin-1-yl)sulfonyl-2-pyridyl]sulfanyl]-N-phenethyl-acetamide CAS Name: 2-[[5-[(4-methyl-1-piperazinyl)sulfonyl]-2-pyridinyl]thio]-N-phenethylacetamide IUPAC Name: 2-[5-(4-methylpiperazin-1-yl)sulfonylpyridin-2-yl]sulfanyl-N-phenethylacetamide Traditional Name: 2-[[5-(4-methylpiperazino)sulfonyl-2-pyridyl]thio]-N-phenethyl-acetamide Formula: C20H26N4O3S2 MolecularWeight: 434.57544

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCC(=O)NCCC3=CC=CC=C3

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCC(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C20H26N4O3S2/c1-23-11-13-24(14-12-23)29(26,27)18-7-8-20(22-15-18)28-16-19(25)21-10-9-17-5-3-2-4-6-17/h2-8,15H,9-14,16H2,1H3,(H,21,25)