(2Z)-2-[[3-ethoxy-4-oxidanyl-5-(phenylsulfanylmethyl)phenyl]methylidene]-4-methyl-thiomorpholin-3-one

Systemtic Name: (2Z)-2-[[3-ethoxy-4-oxidanyl-5-(phenylsulfanylmethyl)phenyl]methylidene]-4-methyl-thiomorpholin-3-one Openeye Name: (2Z)-2-[[3-ethoxy-4-hydroxy-5-(phenylsulfanylmethyl)phenyl]methylene]-4-methyl-thiomorpholin-3-one CAS Name: (2Z)-2-[[3-ethoxy-4-hydroxy-5-[(phenylthio)methyl]phenyl]methylidene]-4-methyl-3-thiomorpholinone IUPAC Name: (2Z)-2-[[3-ethoxy-4-hydroxy-5-(phenylsulfanylmethyl)phenyl]methylidene]-4-methylthiomorpholin-3-one Traditional Name: (2Z)-2-[3-ethoxy-4-hydroxy-5-[(phenylthio)methyl]benzylidene]-4-methyl-thiomorpholin-3-one Formula: C21H23NO3S2 MolecularWeight: 401.54222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1O)CSC2=CC=CC=C2)C=C3C(=O)N(CCS3)C

Isomeric SMILES

CCOC1=CC(=CC(=C1O)CSC2=CC=CC=C2)/C=C\3/C(=O)N(CCS3)C

InChI

InChI=1S/C21H23NO3S2/c1-3-25-18-12-15(13-19-21(24)22(2)9-10-26-19)11-16(20(18)23)14-27-17-7-5-4-6-8-17/h4-8,11-13,23H,3,9-10,14H2,1-2H3/b19-13-