1-[4-(2-hydroxyethylsulfanyl)phenyl]-2-morpholin-4-yl-2-propan-2-yl-pent-4-en-1-one

Systemtic Name: 1-[4-(2-hydroxyethylsulfanyl)phenyl]-2-morpholin-4-yl-2-propan-2-yl-pent-4-en-1-one Openeye Name: 1-[4-(2-hydroxyethylsulfanyl)phenyl]-2-isopropyl-2-morpholino-pent-4-en-1-one CAS Name: 1-[4-(2-hydroxyethylthio)phenyl]-2-(4-morpholinyl)-2-propan-2-yl-4-penten-1-one IUPAC Name: 1-[4-(2-hydroxyethylsulfanyl)phenyl]-2-morpholin-4-yl-2-propan-2-ylpent-4-en-1-one Traditional Name: 1-[4-(2-hydroxyethylthio)phenyl]-2-isopropyl-2-morpholino-pent-4-en-1-one Formula: C20H29NO3S MolecularWeight: 363.51416

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CC=C)(C(=O)C1=CC=C(C=C1)SCCO)N2CCOCC2

Isomeric SMILES

CC(C)C(CC=C)(C(=O)C1=CC=C(C=C1)SCCO)N2CCOCC2

InChI

InChI=1S/C20H29NO3S/c1-4-9-20(16(2)3,21-10-13-24-14-11-21)19(23)17-5-7-18(8-6-17)25-15-12-22/h4-8,16,22H,1,9-15H2,2-3H3