3-[(4-methylphenyl)methyl]-5-(4-propoxyphenyl)thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[(4-methylphenyl)methyl]-5-(4-propoxyphenyl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-(4-propoxyphenyl)-3-(p-tolylmethyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[(4-methylphenyl)methyl]-5-(4-propoxyphenyl)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[(4-methylphenyl)methyl]-5-(4-propoxyphenyl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-(4-methylbenzyl)-5-(4-propoxyphenyl)thieno[2,3-d]pyrimidin-4-one Formula: C23H22N2O2S MolecularWeight: 390.49798

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CC4=CC=C(C=C4)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CC4=CC=C(C=C4)C

InChI

InChI=1S/C23H22N2O2S/c1-3-12-27-19-10-8-18(9-11-19)20-14-28-22-21(20)23(26)25(15-24-22)13-17-6-4-16(2)5-7-17/h4-11,14-15H,3,12-13H2,1-2H3