5-[1-[(4-chloranyl-2-methylsulfonyl-phenyl)methyl]piperidin-4-yl]-3-pyridin-4-yl-1,2,4-oxadiazole

Systemtic Name: 5-[1-[(4-chloranyl-2-methylsulfonyl-phenyl)methyl]piperidin-4-yl]-3-pyridin-4-yl-1,2,4-oxadiazole Openeye Name: 5-[1-[(4-chloro-2-methylsulfonyl-phenyl)methyl]-4-piperidyl]-3-(4-pyridyl)-1,2,4-oxadiazole CAS Name: 5-[1-[(4-chloro-2-methylsulfonylphenyl)methyl]-4-piperidinyl]-3-pyridin-4-yl-1,2,4-oxadiazole IUPAC Name: 5-[1-[(4-chloro-2-methylsulfonylphenyl)methyl]piperidin-4-yl]-3-pyridin-4-yl-1,2,4-oxadiazole Traditional Name: 5-[1-(4-chloro-2-mesyl-benzyl)-4-piperidyl]-3-(4-pyridyl)-1,2,4-oxadiazole Formula: C20H21ClN4O3S MolecularWeight: 432.92374

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=CC(=C1)Cl)CN2CCC(CC2)C3=NC(=NO3)C4=CC=NC=C4

Isomeric SMILES

CS(=O)(=O)C1=C(C=CC(=C1)Cl)CN2CCC(CC2)C3=NC(=NO3)C4=CC=NC=C4

InChI

InChI=1S/C20H21ClN4O3S/c1-29(26,27)18-12-17(21)3-2-16(18)13-25-10-6-15(7-11-25)20-23-19(24-28-20)14-4-8-22-9-5-14/h2-5,8-9,12,15H,6-7,10-11,13H2,1H3