1-methoxy-7-[4-(morpholin-4-ylmethyl)phenyl]thioxanthen-9-one

Systemtic Name: 1-methoxy-7-[4-(morpholin-4-ylmethyl)phenyl]thioxanthen-9-one Openeye Name: 1-methoxy-7-[4-(morpholinomethyl)phenyl]thioxanthen-9-one CAS Name: 1-methoxy-7-[4-(4-morpholinylmethyl)phenyl]-9-thioxanthenone IUPAC Name: 1-methoxy-7-[4-(morpholin-4-ylmethyl)phenyl]thioxanthen-9-one Traditional Name: 1-methoxy-7-[4-(morpholinomethyl)phenyl]thioxanthen-9-one Formula: C25H23NO3S MolecularWeight: 417.52002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC=C1)SC3=C(C2=O)C=C(C=C3)C4=CC=C(C=C4)CN5CCOCC5

Isomeric SMILES

COC1=C2C(=CC=C1)SC3=C(C2=O)C=C(C=C3)C4=CC=C(C=C4)CN5CCOCC5

InChI

InChI=1S/C25H23NO3S/c1-28-21-3-2-4-23-24(21)25(27)20-15-19(9-10-22(20)30-23)18-7-5-17(6-8-18)16-26-11-13-29-14-12-26/h2-10,15H,11-14,16H2,1H3