5-[1-(3-chloranyl-4-methyl-phenyl)sulfonylpiperidin-3-yl]-3-(3-methoxyphenyl)-1,2,4-oxadiazole

Systemtic Name: 5-[1-(3-chloranyl-4-methyl-phenyl)sulfonylpiperidin-3-yl]-3-(3-methoxyphenyl)-1,2,4-oxadiazole Openeye Name: 5-[1-(3-chloro-4-methyl-phenyl)sulfonyl-3-piperidyl]-3-(3-methoxyphenyl)-1,2,4-oxadiazole CAS Name: 5-[1-(3-chloro-4-methylphenyl)sulfonyl-3-piperidinyl]-3-(3-methoxyphenyl)-1,2,4-oxadiazole IUPAC Name: 5-[1-(3-chloro-4-methylphenyl)sulfonylpiperidin-3-yl]-3-(3-methoxyphenyl)-1,2,4-oxadiazole Traditional Name: 5-[1-(3-chloro-4-methyl-phenyl)sulfonyl-3-piperidyl]-3-(3-methoxyphenyl)-1,2,4-oxadiazole Formula: C21H22ClN3O4S MolecularWeight: 447.93508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCC(C2)C3=NC(=NO3)C4=CC(=CC=C4)OC)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCC(C2)C3=NC(=NO3)C4=CC(=CC=C4)OC)Cl

InChI

InChI=1S/C21H22ClN3O4S/c1-14-8-9-18(12-19(14)22)30(26,27)25-10-4-6-16(13-25)21-23-20(24-29-21)15-5-3-7-17(11-15)28-2/h3,5,7-9,11-12,16H,4,6,10,13H2,1-2H3