2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanyl-N-[1-(2-methylpropanoyl)piperidin-4-yl]ethanamide

Systemtic Name: 2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanyl-N-[1-(2-methylpropanoyl)piperidin-4-yl]ethanamide Openeye Name: 2-(4-bromo-2,5-dimethyl-phenyl)sulfanyl-N-[1-(2-methylpropanoyl)-4-piperidyl]acetamide CAS Name: 2-[(4-bromo-2,5-dimethylphenyl)thio]-N-[1-(2-methyl-1-oxopropyl)-4-piperidinyl]acetamide IUPAC Name: 2-(4-bromo-2,5-dimethylphenyl)sulfanyl-N-[1-(2-methylpropanoyl)piperidin-4-yl]acetamide Traditional Name: 2-[(4-bromo-2,5-dimethyl-phenyl)thio]-N-(1-isobutyryl-4-piperidyl)acetamide Formula: C19H27BrN2O2S MolecularWeight: 427.39888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Br)C)SCC(=O)NC2CCN(CC2)C(=O)C(C)C

Isomeric SMILES

CC1=CC(=C(C=C1Br)C)SCC(=O)NC2CCN(CC2)C(=O)C(C)C

InChI

InChI=1S/C19H27BrN2O2S/c1-12(2)19(24)22-7-5-15(6-8-22)21-18(23)11-25-17-10-13(3)16(20)9-14(17)4/h9-10,12,15H,5-8,11H2,1-4H3,(H,21,23)