3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-5-(4-methylphenyl)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-one Formula: C21H16N2O5S2 MolecularWeight: 440.49214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)S(=O)(=O)C4=CC5=C(C=C4)OCCO5

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)S(=O)(=O)C4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C21H16N2O5S2/c1-13-2-4-14(5-3-13)16-11-29-20-19(16)21(24)23(12-22-20)30(25,26)15-6-7-17-18(10-15)28-9-8-27-17/h2-7,10-12H,8-9H2,1H3