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

Systemtic Name: 4-fluoranyl-N-[5-[4-(2-methylphenyl)piperazin-1-yl]sulfonyl-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 4-fluoro-N-[5-[4-(o-tolyl)piperazin-1-yl]sulfonyl-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 4-fluoro-N-[5-[[4-(2-methylphenyl)-1-piperazinyl]sulfonyl]-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 4-fluoro-N-[5-[4-(2-methylphenyl)piperazin-1-yl]sulfonyl-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 4-fluoro-N-[5-[4-(o-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=CC=C1N2CCN(CC2)S(=O)(=O)C3=NN=C(S3)NC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)S(=O)(=O)C3=NN=C(S3)NC(=O)C4=CC=C(C=C4)F

InChI

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