2-phenyl-N5-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-3,4-dihydropyrazole-3,5-dicarboxamide

Systemtic Name: 2-phenyl-N5-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-3,4-dihydropyrazole-3,5-dicarboxamide Openeye Name: N5-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide CAS Name: 2-phenyl-N5-[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]-3,4-dihydropyrazole-3,5-dicarboxamide IUPAC Name: 5-N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide Traditional Name: N-[5-(benzylthio)-1,3,4-thiadiazol-2-yl]-1-phenyl-2-pyrazoline-3,5-dicarboxamide Formula: C20H18N6O2S2 MolecularWeight: 438.52592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(N(N=C1C(=O)NC2=NN=C(S2)SCC3=CC=CC=C3)C4=CC=CC=C4)C(=O)N

Isomeric SMILES

C1C(N(N=C1C(=O)NC2=NN=C(S2)SCC3=CC=CC=C3)C4=CC=CC=C4)C(=O)N

InChI

InChI=1S/C20H18N6O2S2/c21-17(27)16-11-15(25-26(16)14-9-5-2-6-10-14)18(28)22-19-23-24-20(30-19)29-12-13-7-3-1-4-8-13/h1-10,16H,11-12H2,(H2,21,27)(H,22,23,28)