3,4-dimethyl-5-[4-methyl-3-(4-piperidin-1-ylpiperidin-1-yl)sulfonyl-phenyl]-1,2-oxazole

Systemtic Name: 3,4-dimethyl-5-[4-methyl-3-(4-piperidin-1-ylpiperidin-1-yl)sulfonyl-phenyl]-1,2-oxazole Openeye Name: 3,4-dimethyl-5-[4-methyl-3-[[4-(1-piperidyl)-1-piperidyl]sulfonyl]phenyl]isoxazole CAS Name: 3,4-dimethyl-5-[4-methyl-3-[[4-(1-piperidinyl)-1-piperidinyl]sulfonyl]phenyl]isoxazole IUPAC Name: 3,4-dimethyl-5-[4-methyl-3-(4-piperidin-1-ylpiperidin-1-yl)sulfonylphenyl]-1,2-oxazole Traditional Name: 3,4-dimethyl-5-[4-methyl-3-(4-piperidinopiperidino)sulfonyl-phenyl]isoxazole Formula: C22H31N3O3S MolecularWeight: 417.56484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=C(C(=NO2)C)C)S(=O)(=O)N3CCC(CC3)N4CCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)C2=C(C(=NO2)C)C)S(=O)(=O)N3CCC(CC3)N4CCCCC4

InChI

InChI=1S/C22H31N3O3S/c1-16-7-8-19(22-17(2)18(3)23-28-22)15-21(16)29(26,27)25-13-9-20(10-14-25)24-11-5-4-6-12-24/h7-8,15,20H,4-6,9-14H2,1-3H3