4-[[3-methoxy-4-(2-oxidanyl-3-thiomorpholin-4-yl-propoxy)phenyl]methyl]piperazin-2-one

Systemtic Name: 4-[[3-methoxy-4-(2-oxidanyl-3-thiomorpholin-4-yl-propoxy)phenyl]methyl]piperazin-2-one Openeye Name: 4-[[4-(2-hydroxy-3-thiomorpholino-propoxy)-3-methoxy-phenyl]methyl]piperazin-2-one CAS Name: 4-[[4-(2-hydroxy-3-thiomorpholin-4-ylpropoxy)-3-methoxyphenyl]methyl]-2-piperazinone IUPAC Name: 4-[[4-(2-hydroxy-3-thiomorpholin-4-ylpropoxy)-3-methoxyphenyl]methyl]piperazin-2-one Traditional Name: 4-[4-(2-hydroxy-3-thiomorpholino-propoxy)-3-methoxy-benzyl]piperazin-2-one Formula: C19H29N3O4S MolecularWeight: 395.51626

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CN2CCNC(=O)C2)OCC(CN3CCSCC3)O

Isomeric SMILES

COC1=C(C=CC(=C1)CN2CCNC(=O)C2)OCC(CN3CCSCC3)O

InChI

InChI=1S/C19H29N3O4S/c1-25-18-10-15(11-22-5-4-20-19(24)13-22)2-3-17(18)26-14-16(23)12-21-6-8-27-9-7-21/h2-3,10,16,23H,4-9,11-14H2,1H3,(H,20,24)