2-azanyl-2-(2-phenylsulfanylethanoylamino)cyclohexane-1-carboxylic acid

Systemtic Name: 2-azanyl-2-(2-phenylsulfanylethanoylamino)cyclohexane-1-carboxylic acid Openeye Name: 2-amino-2-[(2-phenylsulfanylacetyl)amino]cyclohexanecarboxylic acid CAS Name: 2-amino-2-[[1-oxo-2-(phenylthio)ethyl]amino]-1-cyclohexanecarboxylic acid IUPAC Name: 2-amino-2-[(2-phenylsulfanylacetyl)amino]cyclohexane-1-carboxylic acid Traditional Name: 2-amino-2-[[2-(phenylthio)acetyl]amino]cyclohexanecarboxylic acid Formula: C15H20N2O3S MolecularWeight: 308.3959

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)O)(N)NC(=O)CSC2=CC=CC=C2

Isomeric SMILES

C1CCC(C(C1)C(=O)O)(N)NC(=O)CSC2=CC=CC=C2

InChI

InChI=1S/C15H20N2O3S/c16-15(9-5-4-8-12(15)14(19)20)17-13(18)10-21-11-6-2-1-3-7-11/h1-3,6-7,12H,4-5,8-10,16H2,(H,17,18)(H,19,20)