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

Systemtic Name: 3-methyl-5-[4-methyl-3-(4-piperidin-1-ylpiperidin-1-yl)sulfonyl-phenyl]-1,2-oxazole Openeye Name: 3-methyl-5-[4-methyl-3-[[4-(1-piperidyl)-1-piperidyl]sulfonyl]phenyl]isoxazole CAS Name: 3-methyl-5-[4-methyl-3-[[4-(1-piperidinyl)-1-piperidinyl]sulfonyl]phenyl]isoxazole IUPAC Name: 3-methyl-5-[4-methyl-3-(4-piperidin-1-ylpiperidin-1-yl)sulfonylphenyl]-1,2-oxazole Traditional Name: 3-methyl-5-[4-methyl-3-(4-piperidinopiperidino)sulfonyl-phenyl]isoxazole Formula: C21H29N3O3S MolecularWeight: 403.53826

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29N3O3S/c1-16-6-7-18(20-14-17(2)22-27-20)15-21(16)28(25,26)24-12-8-19(9-13-24)23-10-4-3-5-11-23/h6-7,14-15,19H,3-5,8-13H2,1-2H3