(2,6-dimethoxy-4-morpholin-4-ylcarbothioyl-phenyl) 3-phenylpropanoate

Systemtic Name: (2,6-dimethoxy-4-morpholin-4-ylcarbothioyl-phenyl) 3-phenylpropanoate Openeye Name: [2,6-dimethoxy-4-(morpholine-4-carbothioyl)phenyl] 3-phenylpropanoate CAS Name: 3-phenylpropanoic acid [2,6-dimethoxy-4-[4-morpholinyl(sulfanylidene)methyl]phenyl] ester IUPAC Name: [2,6-dimethoxy-4-(morpholine-4-carbothioyl)phenyl] 3-phenylpropanoate Traditional Name: 3-phenylpropionic acid [2,6-dimethoxy-4-(morpholine-4-carbothioyl)phenyl] ester Formula: C22H25NO5S MolecularWeight: 415.5026

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC(=O)CCC2=CC=CC=C2)OC)C(=S)N3CCOCC3

Isomeric SMILES

COC1=CC(=CC(=C1OC(=O)CCC2=CC=CC=C2)OC)C(=S)N3CCOCC3

InChI

InChI=1S/C22H25NO5S/c1-25-18-14-17(22(29)23-10-12-27-13-11-23)15-19(26-2)21(18)28-20(24)9-8-16-6-4-3-5-7-16/h3-7,14-15H,8-13H2,1-2H3