N-(5-bromanylpyridin-2-yl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]ethanamide

Systemtic Name: N-(5-bromanylpyridin-2-yl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: N-(5-bromo-2-pyridyl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]acetamide CAS Name: N-(5-bromo-2-pyridinyl)-2-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazinyl]acetamide IUPAC Name: N-(5-bromopyridin-2-yl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]acetamide Traditional Name: N-(5-bromo-2-pyridyl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazino]acetamide Formula: C19H23BrN4O3S MolecularWeight: 467.37992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=NC=C(C=C3)Br)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=NC=C(C=C3)Br)C

InChI

InChI=1S/C19H23BrN4O3S/c1-14-3-5-17(15(2)11-14)28(26,27)24-9-7-23(8-10-24)13-19(25)22-18-6-4-16(20)12-21-18/h3-6,11-12H,7-10,13H2,1-2H3,(H,21,22,25)