2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanyl-N-(1-methylsulfonylpiperidin-4-yl)ethanamide

Systemtic Name: 2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanyl-N-(1-methylsulfonylpiperidin-4-yl)ethanamide Openeye Name: 2-(4-bromo-2,5-dimethyl-phenyl)sulfanyl-N-(1-methylsulfonyl-4-piperidyl)acetamide CAS Name: 2-[(4-bromo-2,5-dimethylphenyl)thio]-N-(1-methylsulfonyl-4-piperidinyl)acetamide IUPAC Name: 2-(4-bromo-2,5-dimethylphenyl)sulfanyl-N-(1-methylsulfonylpiperidin-4-yl)acetamide Traditional Name: 2-[(4-bromo-2,5-dimethyl-phenyl)thio]-N-(1-mesyl-4-piperidyl)acetamide Formula: C16H23BrN2O3S2 MolecularWeight: 435.39942

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23BrN2O3S2/c1-11-9-15(12(2)8-14(11)17)23-10-16(20)18-13-4-6-19(7-5-13)24(3,21)22/h8-9,13H,4-7,10H2,1-3H3,(H,18,20)