3-(4-chlorophenyl)-5-[(4-cyclopropyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,2-oxazole

Systemtic Name: 3-(4-chlorophenyl)-5-[(4-cyclopropyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,2-oxazole Openeye Name: 3-(4-chlorophenyl)-5-[[4-cyclopropyl-5-(1-piperidyl)-1,2,4-triazol-3-yl]sulfanylmethyl]isoxazole CAS Name: 3-(4-chlorophenyl)-5-[[[4-cyclopropyl-5-(1-piperidinyl)-1,2,4-triazol-3-yl]thio]methyl]isoxazole IUPAC Name: 3-(4-chlorophenyl)-5-[(4-cyclopropyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,2-oxazole Traditional Name: 3-(4-chlorophenyl)-5-[[(4-cyclopropyl-5-piperidino-1,2,4-triazol-3-yl)thio]methyl]isoxazole Formula: C20H22ClN5OS MolecularWeight: 415.93958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NN=C(N2C3CC3)SCC4=CC(=NO4)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1CCN(CC1)C2=NN=C(N2C3CC3)SCC4=CC(=NO4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C20H22ClN5OS/c21-15-6-4-14(5-7-15)18-12-17(27-24-18)13-28-20-23-22-19(26(20)16-8-9-16)25-10-2-1-3-11-25/h4-7,12,16H,1-3,8-11,13H2