(4-methoxyphenyl)methyl (2R)-3-(cyclohexylmethylsulfanyl)-2-(1,3-thiazol-4-ylcarbonylamino)propanoate

Systemtic Name: (4-methoxyphenyl)methyl (2R)-3-(cyclohexylmethylsulfanyl)-2-(1,3-thiazol-4-ylcarbonylamino)propanoate Openeye Name: (4-methoxyphenyl)methyl (2R)-3-(cyclohexylmethylsulfanyl)-2-(thiazole-4-carbonylamino)propanoate CAS Name: (2R)-3-(cyclohexylmethylthio)-2-[[oxo(4-thiazolyl)methyl]amino]propanoic acid (4-methoxyphenyl)methyl ester IUPAC Name: (4-methoxyphenyl)methyl (2R)-3-(cyclohexylmethylsulfanyl)-2-(1,3-thiazole-4-carbonylamino)propanoate Traditional Name: (2R)-3-(cyclohexylmethylthio)-2-(thiazole-4-carbonylamino)propionic acid p-anisyl ester Formula: C22H28N2O4S2 MolecularWeight: 448.59872

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)COC(=O)C(CSCC2CCCCC2)NC(=O)C3=CSC=N3

Isomeric SMILES

COC1=CC=C(C=C1)COC(=O)[C@H](CSCC2CCCCC2)NC(=O)C3=CSC=N3

InChI

InChI=1S/C22H28N2O4S2/c1-27-18-9-7-16(8-10-18)11-28-22(26)20(24-21(25)19-13-30-15-23-19)14-29-12-17-5-3-2-4-6-17/h7-10,13,15,17,20H,2-6,11-12,14H2,1H3,(H,24,25)/t20-/m0/s1