[(2S)-1-[cyclohexyl(methyl)amino]-1-oxidanylidene-propan-2-yl] 3-(thiophen-2-ylsulfonylamino)propanoate

Systemtic Name: [(2S)-1-[cyclohexyl(methyl)amino]-1-oxidanylidene-propan-2-yl] 3-(thiophen-2-ylsulfonylamino)propanoate Openeye Name: [(1S)-2-[cyclohexyl(methyl)amino]-1-methyl-2-oxo-ethyl] 3-(2-thienylsulfonylamino)propanoate CAS Name: 3-(thiophen-2-ylsulfonylamino)propanoic acid [(2S)-1-[cyclohexyl(methyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-[cyclohexyl(methyl)amino]-1-oxopropan-2-yl] 3-(thiophen-2-ylsulfonylamino)propanoate Traditional Name: 3-(2-thienylsulfonylamino)propionic acid [(1S)-2-[cyclohexyl(methyl)amino]-2-keto-1-methyl-ethyl] ester Formula: C17H26N2O5S2 MolecularWeight: 402.52874

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C)C1CCCCC1)OC(=O)CCNS(=O)(=O)C2=CC=CS2

Isomeric SMILES

C[C@@H](C(=O)N(C)C1CCCCC1)OC(=O)CCNS(=O)(=O)C2=CC=CS2

InChI

InChI=1S/C17H26N2O5S2/c1-13(17(21)19(2)14-7-4-3-5-8-14)24-15(20)10-11-18-26(22,23)16-9-6-12-25-16/h6,9,12-14,18H,3-5,7-8,10-11H2,1-2H3/t13-/m0/s1