5-(4-methylphenyl)-2-(2-morpholin-4-ylethylsulfanyl)-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(4-methylphenyl)-2-(2-morpholin-4-ylethylsulfanyl)-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-allyl-2-(2-morpholinoethylsulfanyl)-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-methylphenyl)-2-[2-(4-morpholinyl)ethylthio]-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-(4-methylphenyl)-2-(2-morpholin-4-ylethylsulfanyl)-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-allyl-2-(2-morpholinoethylthio)-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-one Formula: C22H25N3O2S2 MolecularWeight: 427.5828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)SCCN4CCOCC4)CC=C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)SCCN4CCOCC4)CC=C

InChI

InChI=1S/C22H25N3O2S2/c1-3-8-25-21(26)19-18(17-6-4-16(2)5-7-17)15-29-20(19)23-22(25)28-14-11-24-9-12-27-13-10-24/h3-7,15H,1,8-14H2,2H3