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

Systemtic Name: N-ethyl-N-(4-fluorophenyl)-2-[5-(4-methylpiperazin-1-yl)sulfonylpyridin-2-yl]sulfanyl-ethanamide Openeye Name: N-ethyl-N-(4-fluorophenyl)-2-[[5-(4-methylpiperazin-1-yl)sulfonyl-2-pyridyl]sulfanyl]acetamide CAS Name: N-ethyl-N-(4-fluorophenyl)-2-[[5-[(4-methyl-1-piperazinyl)sulfonyl]-2-pyridinyl]thio]acetamide IUPAC Name: N-ethyl-N-(4-fluorophenyl)-2-[5-(4-methylpiperazin-1-yl)sulfonylpyridin-2-yl]sulfanylacetamide Traditional Name: N-ethyl-N-(4-fluorophenyl)-2-[[5-(4-methylpiperazino)sulfonyl-2-pyridyl]thio]acetamide Formula: C20H25FN4O3S2 MolecularWeight: 452.565903

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=C(C=C1)F)C(=O)CSC2=NC=C(C=C2)S(=O)(=O)N3CCN(CC3)C

Isomeric SMILES

CCN(C1=CC=C(C=C1)F)C(=O)CSC2=NC=C(C=C2)S(=O)(=O)N3CCN(CC3)C

InChI

InChI=1S/C20H25FN4O3S2/c1-3-25(17-6-4-16(21)5-7-17)20(26)15-29-19-9-8-18(14-22-19)30(27,28)24-12-10-23(2)11-13-24/h4-9,14H,3,10-13,15H2,1-2H3