2-morpholin-4-ylethyl 2-[cyclopentylcarbonyl(4-methylsulfonylbutyl)amino]-3-phenyl-propanoate

Systemtic Name: 2-morpholin-4-ylethyl 2-[cyclopentylcarbonyl(4-methylsulfonylbutyl)amino]-3-phenyl-propanoate Openeye Name: 2-morpholinoethyl 2-[cyclopentanecarbonyl(4-methylsulfonylbutyl)amino]-3-phenyl-propanoate CAS Name: 2-[[cyclopentyl(oxo)methyl]-(4-methylsulfonylbutyl)amino]-3-phenylpropanoic acid 2-(4-morpholinyl)ethyl ester IUPAC Name: 2-morpholin-4-ylethyl 2-[cyclopentanecarbonyl(4-methylsulfonylbutyl)amino]-3-phenylpropanoate Traditional Name: 2-[cyclopentanecarbonyl(4-mesylbutyl)amino]-3-phenyl-propionic acid 2-morpholinoethyl ester Formula: C26H40N2O6S MolecularWeight: 508.6706

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCCCN(C(CC1=CC=CC=C1)C(=O)OCCN2CCOCC2)C(=O)C3CCCC3

Isomeric SMILES

CS(=O)(=O)CCCCN(C(CC1=CC=CC=C1)C(=O)OCCN2CCOCC2)C(=O)C3CCCC3

InChI

InChI=1S/C26H40N2O6S/c1-35(31,32)20-8-7-13-28(25(29)23-11-5-6-12-23)24(21-22-9-3-2-4-10-22)26(30)34-19-16-27-14-17-33-18-15-27/h2-4,9-10,23-24H,5-8,11-21H2,1H3