1-[2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanylethanoyl]piperidine-4-carboxamide

Systemtic Name: 1-[2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanylethanoyl]piperidine-4-carboxamide Openeye Name: 1-[2-(4-bromo-2,5-dimethyl-phenyl)sulfanylacetyl]piperidine-4-carboxamide CAS Name: 1-[2-[(4-bromo-2,5-dimethylphenyl)thio]-1-oxoethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-(4-bromo-2,5-dimethylphenyl)sulfanylacetyl]piperidine-4-carboxamide Traditional Name: 1-[2-[(4-bromo-2,5-dimethyl-phenyl)thio]acetyl]isonipecotamide Formula: C16H21BrN2O2S MolecularWeight: 385.31914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Br)C)SCC(=O)N2CCC(CC2)C(=O)N

Isomeric SMILES

CC1=CC(=C(C=C1Br)C)SCC(=O)N2CCC(CC2)C(=O)N

InChI

InChI=1S/C16H21BrN2O2S/c1-10-8-14(11(2)7-13(10)17)22-9-15(20)19-5-3-12(4-6-19)16(18)21/h7-8,12H,3-6,9H2,1-2H3,(H2,18,21)