methyl 3-[3-(6-morpholin-4-yl-4-oxidanylidene-thiopyran-2-yl)phenyl]benzoate

Systemtic Name: methyl 3-[3-(6-morpholin-4-yl-4-oxidanylidene-thiopyran-2-yl)phenyl]benzoate Openeye Name: methyl 3-[3-(6-morpholino-4-oxo-thiopyran-2-yl)phenyl]benzoate CAS Name: 3-[3-[6-(4-morpholinyl)-4-oxo-2-thiopyranyl]phenyl]benzoic acid methyl ester IUPAC Name: methyl 3-[3-(6-morpholin-4-yl-4-oxothiopyran-2-yl)phenyl]benzoate Traditional Name: 3-[3-(4-keto-6-morpholino-thiopyran-2-yl)phenyl]benzoic acid methyl ester Formula: C23H21NO4S MolecularWeight: 407.48214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC(=C1)C2=CC(=CC=C2)C3=CC(=O)C=C(S3)N4CCOCC4

Isomeric SMILES

COC(=O)C1=CC=CC(=C1)C2=CC(=CC=C2)C3=CC(=O)C=C(S3)N4CCOCC4

InChI

InChI=1S/C23H21NO4S/c1-27-23(26)19-7-3-5-17(13-19)16-4-2-6-18(12-16)21-14-20(25)15-22(29-21)24-8-10-28-11-9-24/h2-7,12-15H,8-11H2,1H3