5,6-dimethyl-2-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methylsulfanyl]-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5,6-dimethyl-2-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methylsulfanyl]-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-allyl-5,6-dimethyl-2-[(5-methyl-2-phenyl-oxazol-4-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-2-[(5-methyl-2-phenyl-4-oxazolyl)methylthio]-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5,6-dimethyl-2-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methylsulfanyl]-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-allyl-5,6-dimethyl-2-[(5-methyl-2-phenyl-oxazol-4-yl)methylthio]thieno[2,3-d]pyrimidin-4-one Formula: C22H21N3O2S2 MolecularWeight: 423.55104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)SCC3=C(OC(=N3)C4=CC=CC=C4)C)CC=C)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)SCC3=C(OC(=N3)C4=CC=CC=C4)C)CC=C)C

InChI

InChI=1S/C22H21N3O2S2/c1-5-11-25-21(26)18-13(2)15(4)29-20(18)24-22(25)28-12-17-14(3)27-19(23-17)16-9-7-6-8-10-16/h5-10H,1,11-12H2,2-4H3