2-[2-[(4-bromanyl-2,6-dimethyl-phenyl)sulfonyl-methyl-amino]ethoxy]-N-methyl-N-[(1-pyridin-4-ylpiperidin-4-yl)methyl]ethanamide

Systemtic Name: 2-[2-[(4-bromanyl-2,6-dimethyl-phenyl)sulfonyl-methyl-amino]ethoxy]-N-methyl-N-[(1-pyridin-4-ylpiperidin-4-yl)methyl]ethanamide Openeye Name: 2-[2-[(4-bromo-2,6-dimethyl-phenyl)sulfonyl-methyl-amino]ethoxy]-N-methyl-N-[[1-(4-pyridyl)-4-piperidyl]methyl]acetamide CAS Name: 2-[2-[(4-bromo-2,6-dimethylphenyl)sulfonyl-methylamino]ethoxy]-N-methyl-N-[(1-pyridin-4-yl-4-piperidinyl)methyl]acetamide IUPAC Name: 2-[2-[(4-bromo-2,6-dimethylphenyl)sulfonyl-methylamino]ethoxy]-N-methyl-N-[(1-pyridin-4-ylpiperidin-4-yl)methyl]acetamide Traditional Name: 2-[2-[(4-bromo-2,6-dimethyl-phenyl)sulfonyl-methyl-amino]ethoxy]-N-methyl-N-[[1-(4-pyridyl)-4-piperidyl]methyl]acetamide Formula: C25H35BrN4O4S MolecularWeight: 567.5388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1S(=O)(=O)N(C)CCOCC(=O)N(C)CC2CCN(CC2)C3=CC=NC=C3)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1S(=O)(=O)N(C)CCOCC(=O)N(C)CC2CCN(CC2)C3=CC=NC=C3)C)Br

InChI

InChI=1S/C25H35BrN4O4S/c1-19-15-22(26)16-20(2)25(19)35(32,33)29(4)13-14-34-18-24(31)28(3)17-21-7-11-30(12-8-21)23-5-9-27-10-6-23/h5-6,9-10,15-16,21H,7-8,11-14,17-18H2,1-4H3