1-(4-fluorophenyl)-4-methoxy-N-[5-(pyridin-2-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]pyrazole-3-carboxamide

Systemtic Name: 1-(4-fluorophenyl)-4-methoxy-N-[5-(pyridin-2-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]pyrazole-3-carboxamide Openeye Name: 1-(4-fluorophenyl)-4-methoxy-N-[5-(2-pyridylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]pyrazole-3-carboxamide CAS Name: 1-(4-fluorophenyl)-4-methoxy-N-[5-(2-pyridinylmethylthio)-1,3,4-thiadiazol-2-yl]-3-pyrazolecarboxamide IUPAC Name: 1-(4-fluorophenyl)-4-methoxy-N-[5-(pyridin-2-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]pyrazole-3-carboxamide Traditional Name: 1-(4-fluorophenyl)-4-methoxy-N-[5-(2-pyridylmethylthio)-1,3,4-thiadiazol-2-yl]pyrazole-3-carboxamide Formula: C19H15FN6O2S2 MolecularWeight: 442.489803

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CN(N=C1C(=O)NC2=NN=C(S2)SCC3=CC=CC=N3)C4=CC=C(C=C4)F

Isomeric SMILES

COC1=CN(N=C1C(=O)NC2=NN=C(S2)SCC3=CC=CC=N3)C4=CC=C(C=C4)F

InChI

InChI=1S/C19H15FN6O2S2/c1-28-15-10-26(14-7-5-12(20)6-8-14)25-16(15)17(27)22-18-23-24-19(30-18)29-11-13-4-2-3-9-21-13/h2-10H,11H2,1H3,(H,22,23,27)