methyl (2R)-2-[[(2R)-1-cyclohexylcarbonyl-4-(phenylsulfonyl)piperazin-2-yl]carbonylamino]propanoate

Systemtic Name: methyl (2R)-2-[[(2R)-1-cyclohexylcarbonyl-4-(phenylsulfonyl)piperazin-2-yl]carbonylamino]propanoate Openeye Name: methyl (2R)-2-[[(2R)-4-(benzenesulfonyl)-1-(cyclohexanecarbonyl)piperazine-2-carbonyl]amino]propanoate CAS Name: (2R)-2-[[[(2R)-4-(benzenesulfonyl)-1-[cyclohexyl(oxo)methyl]-2-piperazinyl]-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[(2R)-4-(benzenesulfonyl)-1-(cyclohexanecarbonyl)piperazine-2-carbonyl]amino]propanoate Traditional Name: (2R)-2-[[(2R)-4-besyl-1-(cyclohexanecarbonyl)piperazine-2-carbonyl]amino]propionic acid methyl ester Formula: C22H31N3O6S MolecularWeight: 465.56304

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)NC(=O)C1CN(CCN1C(=O)C2CCCCC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C[C@H](C(=O)OC)NC(=O)[C@H]1CN(CCN1C(=O)C2CCCCC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H31N3O6S/c1-16(22(28)31-2)23-20(26)19-15-24(32(29,30)18-11-7-4-8-12-18)13-14-25(19)21(27)17-9-5-3-6-10-17/h4,7-8,11-12,16-17,19H,3,5-6,9-10,13-15H2,1-2H3,(H,23,26)/t16-,19-/m1/s1