(2S,6S)-2,6-dimethyl-1-(thiophen-2-ylmethylcarbamoylamino)cyclohexane-1-carboxylate

Systemtic Name: (2S,6S)-2,6-dimethyl-1-(thiophen-2-ylmethylcarbamoylamino)cyclohexane-1-carboxylate Openeye Name: (2S,6S)-2,6-dimethyl-1-(2-thienylmethylcarbamoylamino)cyclohexanecarboxylate CAS Name: (2S,6S)-2,6-dimethyl-1-[[oxo-(thiophen-2-ylmethylamino)methyl]amino]-1-cyclohexanecarboxylate IUPAC Name: (2S,6S)-2,6-dimethyl-1-(thiophen-2-ylmethylcarbamoylamino)cyclohexane-1-carboxylate Traditional Name: (2S,6S)-2,6-dimethyl-1-(2-thenylcarbamoylamino)cyclohexanecarboxylate Formula: C15H21N2O3S- MolecularWeight: 309.40384

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1(C(=O)[O-])NC(=O)NCC2=CC=CS2)C

Isomeric SMILES

C[C@H]1CCC[C@@H](C1(C(=O)[O-])NC(=O)NCC2=CC=CS2)C

InChI

InChI=1S/C15H22N2O3S/c1-10-5-3-6-11(2)15(10,13(18)19)17-14(20)16-9-12-7-4-8-21-12/h4,7-8,10-11H,3,5-6,9H2,1-2H3,(H,18,19)(H2,16,17,20)/p-1/t10-,11-/m0/s1