(5S,7R)-3-(methylsulfanylcarbonylamino)adamantane-1-carboxylic acid

Systemtic Name: (5S,7R)-3-(methylsulfanylcarbonylamino)adamantane-1-carboxylic acid Openeye Name: (5S,7R)-3-(methylsulfanylcarbonylamino)adamantane-1-carboxylic acid CAS Name: (5S,7R)-3-[[(methylthio)-oxomethyl]amino]-1-adamantanecarboxylic acid IUPAC Name: (5S,7R)-3-(methylsulfanylcarbonylamino)adamantane-1-carboxylic acid Traditional Name: (5S,7R)-3-[(methylthio)carbonylamino]adamantane-1-carboxylic acid Formula: C13H19NO3S MolecularWeight: 269.35986

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=O)NC12CC3CC(C1)CC(C3)(C2)C(=O)O

Isomeric SMILES

CSC(=O)NC12C[C@@H]3C[C@H](C1)CC(C3)(C2)C(=O)O

InChI

InChI=1S/C13H19NO3S/c1-18-11(17)14-13-5-8-2-9(6-13)4-12(3-8,7-13)10(15)16/h8-9H,2-7H2,1H3,(H,14,17)(H,15,16)/t8-,9+,12?,13?