3-(4-methoxyphenyl)-5-[1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]-1,2,4-oxadiazole

Systemtic Name: 3-(4-methoxyphenyl)-5-[1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]-1,2,4-oxadiazole Openeye Name: 3-(4-methoxyphenyl)-5-[1-(p-tolylsulfonyl)pyrrolidin-2-yl]-1,2,4-oxadiazole CAS Name: 3-(4-methoxyphenyl)-5-[1-(4-methylphenyl)sulfonyl-2-pyrrolidinyl]-1,2,4-oxadiazole IUPAC Name: 3-(4-methoxyphenyl)-5-[1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]-1,2,4-oxadiazole Traditional Name: 3-(4-methoxyphenyl)-5-(1-tosylpyrrolidin-2-yl)-1,2,4-oxadiazole Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C3=NC(=NO3)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C3=NC(=NO3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C20H21N3O4S/c1-14-5-11-17(12-6-14)28(24,25)23-13-3-4-18(23)20-21-19(22-27-20)15-7-9-16(26-2)10-8-15/h5-12,18H,3-4,13H2,1-2H3