2-methyl-N-[[1-(3-methylbutyl)piperidin-4-yl]methyl]-5-(3-methyl-1,2-oxazol-5-yl)benzenesulfonamide

Systemtic Name: 2-methyl-N-[[1-(3-methylbutyl)piperidin-4-yl]methyl]-5-(3-methyl-1,2-oxazol-5-yl)benzenesulfonamide Openeye Name: N-[(1-isopentyl-4-piperidyl)methyl]-2-methyl-5-(3-methylisoxazol-5-yl)benzenesulfonamide CAS Name: 2-methyl-N-[[1-(3-methylbutyl)-4-piperidinyl]methyl]-5-(3-methyl-5-isoxazolyl)benzenesulfonamide IUPAC Name: 2-methyl-N-[[1-(3-methylbutyl)piperidin-4-yl]methyl]-5-(3-methyl-1,2-oxazol-5-yl)benzenesulfonamide Traditional Name: N-[(1-isoamyl-4-piperidyl)methyl]-2-methyl-5-(3-methylisoxazol-5-yl)benzenesulfonamide Formula: C22H33N3O3S MolecularWeight: 419.58072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CC(=NO2)C)S(=O)(=O)NCC3CCN(CC3)CCC(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CC(=NO2)C)S(=O)(=O)NCC3CCN(CC3)CCC(C)C

InChI

InChI=1S/C22H33N3O3S/c1-16(2)7-10-25-11-8-19(9-12-25)15-23-29(26,27)22-14-20(6-5-17(22)3)21-13-18(4)24-28-21/h5-6,13-14,16,19,23H,7-12,15H2,1-4H3