2-(4-methylphenyl)-5-[(4-phenyl-1H-pyrazol-5-yl)sulfonylmethyl]-1,3,4-thiadiazole

Systemtic Name: 2-(4-methylphenyl)-5-[(4-phenyl-1H-pyrazol-5-yl)sulfonylmethyl]-1,3,4-thiadiazole Openeye Name: 2-[(4-phenyl-1H-pyrazol-5-yl)sulfonylmethyl]-5-(p-tolyl)-1,3,4-thiadiazole CAS Name: 2-(4-methylphenyl)-5-[(4-phenyl-1H-pyrazol-5-yl)sulfonylmethyl]-1,3,4-thiadiazole IUPAC Name: 2-(4-methylphenyl)-5-[(4-phenyl-1H-pyrazol-5-yl)sulfonylmethyl]-1,3,4-thiadiazole Traditional Name: 2-[(4-phenyl-1H-pyrazol-5-yl)sulfonylmethyl]-5-(p-tolyl)-1,3,4-thiadiazole Formula: C19H16N4O2S2 MolecularWeight: 396.48594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(S2)CS(=O)(=O)C3=C(C=NN3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(S2)CS(=O)(=O)C3=C(C=NN3)C4=CC=CC=C4

InChI

InChI=1S/C19H16N4O2S2/c1-13-7-9-15(10-8-13)18-22-21-17(26-18)12-27(24,25)19-16(11-20-23-19)14-5-3-2-4-6-14/h2-11H,12H2,1H3,(H,20,23)