(4-methoxyphenyl)methyl (2R)-2-(cyclohexylcarbonylamino)-3-(cyclohexylmethylsulfanyl)propanoate

Systemtic Name: (4-methoxyphenyl)methyl (2R)-2-(cyclohexylcarbonylamino)-3-(cyclohexylmethylsulfanyl)propanoate Openeye Name: (4-methoxyphenyl)methyl (2R)-2-(cyclohexanecarbonylamino)-3-(cyclohexylmethylsulfanyl)propanoate CAS Name: (2R)-3-(cyclohexylmethylthio)-2-[[cyclohexyl(oxo)methyl]amino]propanoic acid (4-methoxyphenyl)methyl ester IUPAC Name: (4-methoxyphenyl)methyl (2R)-2-(cyclohexanecarbonylamino)-3-(cyclohexylmethylsulfanyl)propanoate Traditional Name: (2R)-2-(cyclohexanecarbonylamino)-3-(cyclohexylmethylthio)propionic acid p-anisyl ester Formula: C25H37NO4S MolecularWeight: 447.63058

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)COC(=O)C(CSCC2CCCCC2)NC(=O)C3CCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)COC(=O)[C@H](CSCC2CCCCC2)NC(=O)C3CCCCC3

InChI

InChI=1S/C25H37NO4S/c1-29-22-14-12-19(13-15-22)16-30-25(28)23(18-31-17-20-8-4-2-5-9-20)26-24(27)21-10-6-3-7-11-21/h12-15,20-21,23H,2-11,16-18H2,1H3,(H,26,27)/t23-/m0/s1