methyl (2R)-2-acetamido-3-(2-bromanylcyclohexyl)sulfanyl-propanoate

Systemtic Name: methyl (2R)-2-acetamido-3-(2-bromanylcyclohexyl)sulfanyl-propanoate Openeye Name: methyl (2R)-2-acetamido-3-(2-bromocyclohexyl)sulfanyl-propanoate CAS Name: (2R)-2-acetamido-3-[(2-bromocyclohexyl)thio]propanoic acid methyl ester IUPAC Name: methyl (2R)-2-acetamido-3-(2-bromocyclohexyl)sulfanylpropanoate Traditional Name: (2R)-2-acetamido-3-[(2-bromocyclohexyl)thio]propionic acid methyl ester Formula: C12H20BrNO3S MolecularWeight: 338.2611

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CSC1CCCCC1Br)C(=O)OC

Isomeric SMILES

CC(=O)N[C@@H](CSC1CCCCC1Br)C(=O)OC

InChI

InChI=1S/C12H20BrNO3S/c1-8(15)14-10(12(16)17-2)7-18-11-6-4-3-5-9(11)13/h9-11H,3-7H2,1-2H3,(H,14,15)/t9?,10-,11?/m0/s1