S-(2-methoxysulfanylethyl) (E)-7-[2-morpholin-4-yl-3-oxidanylidene-5-[(4-phenylphenyl)methoxy]cyclopentyl]hept-4-enethioate

Systemtic Name: S-(2-methoxysulfanylethyl) (E)-7-[2-morpholin-4-yl-3-oxidanylidene-5-[(4-phenylphenyl)methoxy]cyclopentyl]hept-4-enethioate Openeye Name: S-(2-methoxysulfanylethyl) (E)-7-[2-morpholino-3-oxo-5-[(4-phenylphenyl)methoxy]cyclopentyl]hept-4-enethioate CAS Name: (E)-7-[2-(4-morpholinyl)-3-oxo-5-[(4-phenylphenyl)methoxy]cyclopentyl]-4-heptenethioic acid S-[2-(methoxythio)ethyl] ester IUPAC Name: S-(2-methoxysulfanylethyl) (E)-7-[2-morpholin-4-yl-3-oxo-5-[(4-phenylphenyl)methoxy]cyclopentyl]hept-4-enethioate Traditional Name: (E)-7-[3-keto-2-morpholino-5-(4-phenylbenzyl)oxy-cyclopentyl]hept-4-enethioic acid S-[2-(methoxythio)ethyl] ester Formula: C32H41NO5S2 MolecularWeight: 583.80164

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Descriptors Computed from Structure

Canonical SMILES:

COSCCSC(=O)CCC=CCCC1C(CC(=O)C1N2CCOCC2)OCC3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

COSCCSC(=O)CC/C=C/CCC1C(CC(=O)C1N2CCOCC2)OCC3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C32H41NO5S2/c1-36-40-22-21-39-31(35)12-8-3-2-7-11-28-30(23-29(34)32(28)33-17-19-37-20-18-33)38-24-25-13-15-27(16-14-25)26-9-5-4-6-10-26/h2-6,9-10,13-16,28,30,32H,7-8,11-12,17-24H2,1H3/b3-2+