3-(2-oxidanylidenepropyl)-5-(4-propan-2-ylphenyl)thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-(2-oxidanylidenepropyl)-5-(4-propan-2-ylphenyl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-acetonyl-5-(4-isopropylphenyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 3-(2-oxopropyl)-5-(4-propan-2-ylphenyl)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-(2-oxopropyl)-5-(4-propan-2-ylphenyl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-acetonyl-5-p-cumenyl-thieno[2,3-d]pyrimidin-4-one Formula: C18H18N2O2S MolecularWeight: 326.41272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O2S/c1-11(2)13-4-6-14(7-5-13)15-9-23-17-16(15)18(22)20(10-19-17)8-12(3)21/h4-7,9-11H,8H2,1-3H3