2-methyl-1-(3-methylsulfanyl-4-morpholin-4-yl-phenyl)-2-morpholin-4-yl-butan-1-one

Systemtic Name: 2-methyl-1-(3-methylsulfanyl-4-morpholin-4-yl-phenyl)-2-morpholin-4-yl-butan-1-one Openeye Name: 2-methyl-1-(3-methylsulfanyl-4-morpholino-phenyl)-2-morpholino-butan-1-one CAS Name: 2-methyl-1-[3-(methylthio)-4-(4-morpholinyl)phenyl]-2-(4-morpholinyl)-1-butanone IUPAC Name: 2-methyl-1-(3-methylsulfanyl-4-morpholin-4-ylphenyl)-2-morpholin-4-ylbutan-1-one Traditional Name: 2-methyl-1-[3-(methylthio)-4-morpholino-phenyl]-2-morpholino-butan-1-one Formula: C20H30N2O3S MolecularWeight: 378.5288

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C(=O)C1=CC(=C(C=C1)N2CCOCC2)SC)N3CCOCC3

Isomeric SMILES

CCC(C)(C(=O)C1=CC(=C(C=C1)N2CCOCC2)SC)N3CCOCC3

InChI

InChI=1S/C20H30N2O3S/c1-4-20(2,22-9-13-25-14-10-22)19(23)16-5-6-17(18(15-16)26-3)21-7-11-24-12-8-21/h5-6,15H,4,7-14H2,1-3H3