3-[[4-(4-methylphenyl)-5-piperidin-1-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-5-thiophen-2-yl-1,2,4-oxadiazole

Systemtic Name: 3-[[4-(4-methylphenyl)-5-piperidin-1-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-5-thiophen-2-yl-1,2,4-oxadiazole Openeye Name: 3-[[5-(1-piperidyl)-4-(p-tolyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-5-(2-thienyl)-1,2,4-oxadiazole CAS Name: 3-[[[4-(4-methylphenyl)-5-(1-piperidinyl)-1,2,4-triazol-3-yl]thio]methyl]-5-thiophen-2-yl-1,2,4-oxadiazole IUPAC Name: 3-[[4-(4-methylphenyl)-5-piperidin-1-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-5-thiophen-2-yl-1,2,4-oxadiazole Traditional Name: 3-[[[5-piperidino-4-(p-tolyl)-1,2,4-triazol-3-yl]thio]methyl]-5-(2-thienyl)-1,2,4-oxadiazole Formula: C21H22N6OS2 MolecularWeight: 438.56898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=NOC(=N3)C4=CC=CS4)N5CCCCC5

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=NOC(=N3)C4=CC=CS4)N5CCCCC5

InChI

InChI=1S/C21H22N6OS2/c1-15-7-9-16(10-8-15)27-20(26-11-3-2-4-12-26)23-24-21(27)30-14-18-22-19(28-25-18)17-6-5-13-29-17/h5-10,13H,2-4,11-12,14H2,1H3