3-fluoranyl-N-[5-[4-(4-methylphenyl)piperazin-1-yl]sulfonyl-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 3-fluoranyl-N-[5-[4-(4-methylphenyl)piperazin-1-yl]sulfonyl-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 3-fluoro-N-[5-[4-(p-tolyl)piperazin-1-yl]sulfonyl-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 3-fluoro-N-[5-[[4-(4-methylphenyl)-1-piperazinyl]sulfonyl]-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 3-fluoro-N-[5-[4-(4-methylphenyl)piperazin-1-yl]sulfonyl-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 3-fluoro-N-[5-[4-(p-tolyl)piperazino]sulfonyl-1,3,4-thiadiazol-2-yl]benzamide Formula: C20H20FN5O3S2 MolecularWeight: 461.532903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CCN(CC2)S(=O)(=O)C3=NN=C(S3)NC(=O)C4=CC(=CC=C4)F

Isomeric SMILES

CC1=CC=C(C=C1)N2CCN(CC2)S(=O)(=O)C3=NN=C(S3)NC(=O)C4=CC(=CC=C4)F

InChI

InChI=1S/C20H20FN5O3S2/c1-14-5-7-17(8-6-14)25-9-11-26(12-10-25)31(28,29)20-24-23-19(30-20)22-18(27)15-3-2-4-16(21)13-15/h2-8,13H,9-12H2,1H3,(H,22,23,27)