N-(4-methylphenyl)-5-[[2-oxidanylidene-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]sulfanylmethyl]-1,3,4-thiadiazole-2-carboxamide

Systemtic Name: N-(4-methylphenyl)-5-[[2-oxidanylidene-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]sulfanylmethyl]-1,3,4-thiadiazole-2-carboxamide Openeye Name: 5-[[2-oxo-2-[4-(2-pyridyl)piperazin-1-yl]ethyl]sulfanylmethyl]-N-(p-tolyl)-1,3,4-thiadiazole-2-carboxamide CAS Name: N-(4-methylphenyl)-5-[[[2-oxo-2-[4-(2-pyridinyl)-1-piperazinyl]ethyl]thio]methyl]-1,3,4-thiadiazole-2-carboxamide IUPAC Name: N-(4-methylphenyl)-5-[[2-oxo-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]sulfanylmethyl]-1,3,4-thiadiazole-2-carboxamide Traditional Name: 5-[[[2-keto-2-[4-(2-pyridyl)piperazino]ethyl]thio]methyl]-N-(p-tolyl)-1,3,4-thiadiazole-2-carboxamide Formula: C22H24N6O2S2 MolecularWeight: 468.59496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=NN=C(S2)CSCC(=O)N3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=NN=C(S2)CSCC(=O)N3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C22H24N6O2S2/c1-16-5-7-17(8-6-16)24-21(30)22-26-25-19(32-22)14-31-15-20(29)28-12-10-27(11-13-28)18-4-2-3-9-23-18/h2-9H,10-15H2,1H3,(H,24,30)