2-ethyl-2-morpholin-4-yl-1-[4-(3-oxidanylidene-3-phenyl-propyl)sulfanylphenyl]hexan-1-one

Systemtic Name: 2-ethyl-2-morpholin-4-yl-1-[4-(3-oxidanylidene-3-phenyl-propyl)sulfanylphenyl]hexan-1-one Openeye Name: 2-ethyl-2-morpholino-1-[4-(3-oxo-3-phenyl-propyl)sulfanylphenyl]hexan-1-one CAS Name: 2-ethyl-2-(4-morpholinyl)-1-[4-[(3-oxo-3-phenylpropyl)thio]phenyl]-1-hexanone IUPAC Name: 2-ethyl-2-morpholin-4-yl-1-[4-(3-oxo-3-phenylpropyl)sulfanylphenyl]hexan-1-one Traditional Name: 2-ethyl-1-[4-[(3-keto-3-phenyl-propyl)thio]phenyl]-2-morpholino-hexan-1-one Formula: C27H35NO3S MolecularWeight: 453.6367

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)(C(=O)C1=CC=C(C=C1)SCCC(=O)C2=CC=CC=C2)N3CCOCC3

Isomeric SMILES

CCCCC(CC)(C(=O)C1=CC=C(C=C1)SCCC(=O)C2=CC=CC=C2)N3CCOCC3

InChI

InChI=1S/C27H35NO3S/c1-3-5-16-27(4-2,28-17-19-31-20-18-28)26(30)23-11-13-24(14-12-23)32-21-15-25(29)22-9-7-6-8-10-22/h6-14H,3-5,15-21H2,1-2H3